Geometry & MOs

Info

ID:	222244
PubChem CID:	85295569
Reduced:	NO2C16H23 (1)
Stoich.:	AB2C16D23 (1)
Weight, g/mol:	263.170771
ΔH_f, kcal/mol:	-83.69
Dipole, Da:	3.61
IP(EA), eV:	-9.31(0.2)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

2-benzylsulfanyl-N-propan-2-ylcyclohexan-1-amine

Drug info:

PubChemData

Smile

CC(C)(C)C1=CC=CC=C1N2C(CCC2=O)COC

DOS

IR

Vibrations