Geometry & MOs

Info

ID:	217736
PubChem CID:	85088296
Reduced:	ClFON5C20H21 (1)
Stoich.:	ABCD5E20F21 (1)
Weight, g/mol:	393.116542
ΔH_f, kcal/mol:	1.3
Dipole, Da:	5.57
IP(EA), eV:	-8.84(-0.41)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

N-(2-chloro-5-phenylmethoxycyclohexyl)-4-methylbenzenesulfonamide

Drug info:

PubChemData

Smile

CN1C2C(CN1)C3C(C(N2)C4=CC(=CC=C4)F)C(=O)N(N3)C5=CC=C(C=C5)Cl

DOS

IR

Vibrations