Geometry & MOs

Info

ID:	84130
PubChem CID:	49864433
Reduced:	N5O5C10H19 (1)
Stoich.:	A5B5C10D19 (1)
Weight, g/mol:	508.167747
ΔH_f, kcal/mol:	-230.59
Dipole, Da:	2.05
IP(EA), eV:	-9.96(-0.17)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

(3R,4R)-4-N-(4-chlorophenyl)-1-(cyclopropylmethyl)-3-N-[2-fluoro-4-(2-oxopyridin-1-yl)phenyl]pyrrolidine-3,4-dicarboxamide

Drug info:

PubChemData

Smile

C(C[C@@H](C(=O)NCC(=O)O)N)CNC(=O)NC(=O)CN

DOS

IR

Vibrations