Geometry & MOs

Info

ID:	345936
PubChem CID:	127270236
Reduced:	FO2N5C20H26 (1)
Stoich.:	AB2C5D20E26 (1)
Weight, g/mol:	376.227454
ΔH_f, kcal/mol:	-100.56
Dipole, Da:	7.02
IP(EA), eV:	-9.07(-0.29)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

N-cyclohexyl-2-[3-[(4-fluorophenyl)carbamoylamino]pyrrolidin-1-yl]propanamide

Drug info:

PubChemData

Smile

C1CCC(CC1)(C#N)NC(=O)CN2CCC(C2)NC(=O)NC3=CC=C(C=C3)F

DOS

IR

Vibrations