Geometry & MOs

Info

ID:	277011
PubChem CID:	103826230
Reduced:	BrON4H13C14 (1)
Stoich.:	ABC4D13E14 (1)
Weight, g/mol:	284.09277
ΔH_f, kcal/mol:	60.02
Dipole, Da:	3.04
IP(EA), eV:	-8.2(-0.18)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

2-chloro-N-(3-methoxycyclohexyl)-4-nitroaniline

Drug info:

PubChemData

Smile

CC1=NC(=NN1)C2=CC(=CC=C2)NCC3=C(C=CO3)Br

DOS

IR

Vibrations