Geometry & MOs

Info

ID:	309168
PubChem CID:	126539363
Reduced:	FN4C17H29 (1)
Stoich.:	AB4C17D29 (1)
Weight, g/mol:	435.161012
ΔH_f, kcal/mol:	-40.01
Dipole, Da:	1.42
IP(EA), eV:	-8.33(0.07)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

1-[4-[4-[4-(3,4-difluorophenyl)-3,5-difluorophenyl]phenyl]phenyl]propan-1-amine

Drug info:

PubChemData

Smile

CC(C)CN1CCN(CC1)C(C)(C)CNC2=C(C=CC=N2)F

DOS

IR

Vibrations