Geometry & MOs

Info

ID:	178895
PubChem CID:	76398128
Reduced:	ON4C20H26 (1)
Stoich.:	AB4C20D26 (1)
Weight, g/mol:	376.130218
ΔH_f, kcal/mol:	14.56
Dipole, Da:	5.63
IP(EA), eV:	-8.58(0.14)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

5-(3-chlorophenyl)-4-[2-(1H-imidazol-5-yl)ethylcarbamoyl]-1-methylpyrrolidine-2-carboxylic acid

Drug info:

PubChemData

Smile

CC1=CC=C(C=C1)C2CNNC2C3CCCN(C3)C(=O)C4=CC=CN4

DOS

IR

Vibrations