Geometry & MOs

Info

ID:	244701
PubChem CID:	99376451
Reduced:	F2N3O3C19H19 (1)
Stoich.:	A2B3C3D19E19 (1)
Weight, g/mol:	387.194677
ΔH_f, kcal/mol:	-170.17
Dipole, Da:	5.93
IP(EA), eV:	-9.4(-0.7)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

N-[3-oxo-3-(pyridin-4-ylmethylamino)propyl]-2-(2-phenylethyl)benzamide

Drug info:

PubChemData

Smile

C1=CC(=CC=C1/C=C/C(=O)NCCC(=O)NCC2=CC=NC=C2)OC(F)F

DOS

IR

Vibrations