Geometry & MOs

Info

ID:	203462
PubChem CID:	79833754
Reduced:	N2O3C14H18 (1)
Stoich.:	A2B3C14D18 (1)
Weight, g/mol:	261.17625
ΔH_f, kcal/mol:	-109.14
Dipole, Da:	5.59
IP(EA), eV:	-9.57(-0.57)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

1-(3-ethylsulfonylpropyl)-2,2-dimethylcyclohexan-1-amine

Drug info:

PubChemData

Smile

CC1=C(N=CC=C1)C(=O)N2CCCC[C@@H]2C(=O)OC

DOS

IR

Vibrations