Geometry & MOs

Info

ID:	198595
PubChem CID:	79121891
Reduced:	SN2O2C15H22 (1)
Stoich.:	AB2C2D15E22 (1)
Weight, g/mol:	266.18167
ΔH_f, kcal/mol:	-50.67
Dipole, Da:	6.81
IP(EA), eV:	-9.2(-0.9)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

1-N,4-N-dimethyl-4-N-(1-thiophen-2-ylpropyl)cyclohexane-1,4-diamine

Drug info:

PubChemData

Smile

CN(C1CCC(CC1)N)S(=O)(=O)C=CC2=CC=CC=C2

DOS

IR

Vibrations