Geometry & MOs

Info

ID:	237088
PubChem CID:	92717212
Reduced:	ClFNO4H21C25 (1)
Stoich.:	ABCD4E21F25 (1)
Weight, g/mol:	297.184112
ΔH_f, kcal/mol:	-153.5
Dipole, Da:	4.95
IP(EA), eV:	-9.46(-1.04)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

(4S)-1-(cyclopropylmethyl)-4-(1-propan-2-ylbenzimidazol-2-yl)pyrrolidin-2-one

Drug info:

PubChemData

Smile

C1=CC=C(C=C1)[C@H](C2=CC=C(C=C2)Cl)NC(=O)COC(=O)CCC(=O)C3=CC=C(C=C3)F

DOS

IR

Vibrations