Geometry & MOs

Info

ID:	156176
PubChem CID:	56369410
Reduced:	N2O3C22H26 (1)
Stoich.:	A2B3C22D26 (1)
Weight, g/mol:	401.071324
ΔH_f, kcal/mol:	-106.22
Dipole, Da:	2.78
IP(EA), eV:	-9.02(-0.15)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

N-(3-chloro-4-imidazol-1-ylphenyl)-2-[2-(2-oxopyrrolidin-1-yl)-1,3-thiazol-4-yl]acetamide

Drug info:

PubChemData

Smile

CCC(=O)NC1CCCN(C1)C(=O)C2=C(C=CC(=C2)CC3=CC=CC=C3)O

DOS

IR

Vibrations