Geometry & MOs

Info

ID:	128960
PubChem CID:	51064213
Reduced:	OBr3N3C18H20 (1)
Stoich.:	AB3C3D18E20 (1)
Weight, g/mol:	397.09021
ΔH_f, kcal/mol:	19.33
Dipole, Da:	7.97
IP(EA), eV:	-8.68(-0.53)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

N'-[3-[(4-bromophenyl)diazenyl]-1-methylindol-2-yl]-N,N-dimethylethanimidamide

Drug info:

PubChemData

Smile

CC\1=CCC(C/C1=N/NC(=O)CNC2=CC(=C(C=C2Br)Br)Br)C(=C)C

DOS

IR

Vibrations