Geometry & MOs

Info

ID:	141229
PubChem CID:	52843149
Reduced:	N3O5C21H31 (1)
Stoich.:	A3B5C21D31 (1)
Weight, g/mol:	366.155512
ΔH_f, kcal/mol:	-219.97
Dipole, Da:	4.07
IP(EA), eV:	-8.75(-0.03)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

(3R)-1-(cyclopropylmethyl)-5-oxo-N-[(1R,2R)-2-[2-(trifluoromethyl)phenyl]cyclopropyl]pyrrolidine-3-carboxamide

Drug info:

PubChemData

Smile

CCN1C(=C(C(=C1C)C(=O)OCC)/C=C/C(=O)N2CCCN(CC2)C(=O)OC)C

DOS

IR

Vibrations