Geometry & MOs

Info

ID:	257237
PubChem CID:	103144575
Reduced:	BrOF2N2H13C15 (1)
Stoich.:	ABC2D2E13F15 (1)
Weight, g/mol:	268.157563
ΔH_f, kcal/mol:	-98.72
Dipole, Da:	4.38
IP(EA), eV:	-8.06(-1.2)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

N-(4-amino-2,5-dimethylphenyl)-3,4-dimethylbenzamide

Drug info:

PubChemData

Smile

CC1=CC(=C(C=C1NC(=O)C2=C(C=C(C=C2F)Br)F)C)N

DOS

IR

Vibrations