Geometry & MOs

Info

ID:	161263
PubChem CID:	57391192
Reduced:	BrNO2C26H26 (1)
Stoich.:	ABC2D26E26 (1)
Weight, g/mol:	400.125692
ΔH_f, kcal/mol:	-13.1
Dipole, Da:	4.52
IP(EA), eV:	-8.95(-0.82)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

2-[3-fluoro-4-(methanesulfonamido)phenyl]-N-(naphthalen-2-ylmethyl)propanamide

Drug info:

PubChemData

Smile

CC(C)CC1=CC=C(C=C1)C(C)C(=O)OC2=CC=C(C=C2)N=CC3=CC=C(C=C3)Br

DOS

IR

Vibrations