Geometry & MOs

Info

ID:	38881
PubChem CID:	8138101
Reduced:	SN4O4C19H24 (1)
Stoich.:	AB4C4D19E24 (1)
Weight, g/mol:	314.13789
ΔH_f, kcal/mol:	-105.22
Dipole, Da:	6.58
IP(EA), eV:	-9.52(-1.07)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

N-[(1S)-3-oxo-1-phenyl-3-[2-(1H-pyrrole-2-carbonyl)hydrazinyl]propyl]acetamide

Drug info:

PubChemData

Smile

C[C@@H]1C[C@H](CN(C1)S(=O)(=O)C2=CC=C(C=C2)C(=O)NNC(=O)C3=CC=CN3)C

DOS

IR

Vibrations