Geometry & MOs

Info

ID:	446439
PubChem CID:	135274995
Reduced:	NF2C7H13 (1)
Stoich.:	AB2C7D13 (1)
Weight, g/mol:	418.141674
ΔH_f, kcal/mol:	-100.04
Dipole, Da:	1.39
IP(EA), eV:	-9.62(0.76)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

N-[4-(3,4-difluorophenyl)pyrrolidin-3-yl]-2,6-difluoro-4-(2-methylpyrazol-3-yl)benzamide

Drug info:

PubChemData

Smile

CCCNC(C(C=C)F)F

DOS

IR

Vibrations