Geometry & MOs

Info

ID:	30273
PubChem CID:	841072
Reduced:	FNO3H16C19 (1)
Stoich.:	ABC3D16E19 (1)
Weight, g/mol:	318.07712
ΔH_f, kcal/mol:	-89.05
Dipole, Da:	2.13
IP(EA), eV:	-8.91(-0.85)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

2-chloro-4-nitro-N-[(1S)-1-phenylpropyl]benzamide

Drug info:

PubChemData

Smile

CC1=CC(=CC=C1)NC(=O)C2=CC=C(O2)COC3=CC=C(C=C3)F

DOS

IR

Vibrations