Geometry & MOs

Info

ID:	433584
PubChem CID:	135173724
Reduced:	SN6O6C26H33 (2)
Stoich.:	AB6C6D26E33 (2)
Weight, g/mol:	142.074228
ΔH_f, kcal/mol:	-384.91
Dipole, Da:	10.1
IP(EA), eV:	-8.94(-1.47)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

N-(1-methyl-4-oxopyrrolidin-3-yl)formamide

Drug info:

Smile

C[C@H]1C(=O)N([C@H]2C(SC[C@@H](C(=O)N([C@H](C(=O)OCC[C@H](C(=O)N1)NC(=O)C3=NC4=CC=CC=C4N=C3)C(C)C)C)N(C(=O)[C@@H](NC(=O)[C@@H](COC(=O)[C@@H](N(C2=O)C)C(C)C)NC(=O)C5=NC6=CC=CC=C6N=C5)C)C)SC)C

DOS

IR

Vibrations