Geometry & MOs

Info

ID:	433166
PubChem CID:	135173303
Reduced:	NC23H49 (1)
Stoich.:	AB23C49 (1)
Weight, g/mol:	401.133065
ΔH_f, kcal/mol:	-87.52
Dipole, Da:	1.64
IP(EA), eV:	-8.48(3.23)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

[4-[cyclopropyl(methylsulfonyl)amino]cyclohexyl]methyl 4-methylbenzenesulfonate

Drug info:

PubChemData

Smile

CCCC(C)C(C)CC(C)(C)C(C(C)(C)CC(C)(C)C(C)C)NC

DOS

IR

Vibrations