Geometry & MOs

Info

ID:	160168
PubChem CID:	57304894
Reduced:	Cl2O3C18H18 (1)
Stoich.:	A2B3C18D18 (1)
Weight, g/mol:	254.99286
ΔH_f, kcal/mol:	-122.21
Dipole, Da:	6.17
IP(EA), eV:	-9.58(-1.45)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

(4-bromocyclohexyl)methanesulfonamide

Drug info:

PubChemData

Smile

CCCC12CCCC=C1C3=C(C2=O)C=C(C(=C3Cl)Cl)CC(=O)O

DOS

IR

Vibrations