Geometry & MOs

Info

ID:	35591
PubChem CID:	7980073
Reduced:	N3O4C24H29 (1)
Stoich.:	A3B4C24D29 (1)
Weight, g/mol:	423.215806
ΔH_f, kcal/mol:	-124.54
Dipole, Da:	4.76
IP(EA), eV:	-8.16(-0.5)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

(3S)-N'-(4-tert-butylbenzoyl)-1-(4-ethoxyphenyl)-5-oxopyrrolidine-3-carbohydrazide

Drug info:

PubChemData

Smile

CCOC1=CC=C(C=C1)N2C[C@@H](CC2=O)C(=O)NNC(=O)C3=CC=C(C=C3)C(C)(C)C

DOS

IR

Vibrations