Geometry & MOs

Info

ID:	171739
PubChem CID:	75420141
Reduced:	O2N5C21H27 (1)
Stoich.:	A2B5C21D27 (1)
Weight, g/mol:	335.108148
ΔH_f, kcal/mol:	-39.98
Dipole, Da:	7.55
IP(EA), eV:	-8.99(-0.64)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

2,6-difluoro-N-[2-(2-methyl-6-nitroanilino)ethyl]benzamide

Drug info:

PubChemData

Smile

CC(C)C(C1=NN=C2N1CCC2)NC(=O)C(=O)NC3=CC=CC4=C3CCCC4

DOS

IR

Vibrations