Geometry & MOs

Info

ID:	437693
PubChem CID:	135226858
Reduced:	BrIOSN2H8C9 (1)
Stoich.:	ABCDE2F8G9 (1)
Weight, g/mol:	325.04998
ΔH_f, kcal/mol:	6.67
Dipole, Da:	2.39
IP(EA), eV:	-8.77(-2.61)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

2-bromo-N-cyclohexyl-4-cyclopropylsulfanylaniline

Drug info:

PubChemData

Smile

CC1=CC2=C(N1SI)C(=O)N(C=C2Br)C

DOS

IR

Vibrations