Geometry & MOs

Info

ID:	156626
PubChem CID:	56371398
Reduced:	O3N4C25H28 (1)
Stoich.:	A3B4C25D28 (1)
Weight, g/mol:	419.232125
ΔH_f, kcal/mol:	-66.59
Dipole, Da:	2.41
IP(EA), eV:	-8.42(-0.14)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

N-[5-(dimethylcarbamoyl)-2-methylphenyl]-2-(1-ethylbenzimidazol-2-yl)pyrrolidine-1-carboxamide

Drug info:

PubChemData

Smile

CCN1C2=CC=CC=C2N=C1C3CCCN3C(=O)NC4=CC5=C(C=C4)OC6(O5)CCCC6

DOS

IR

Vibrations