Geometry & MOs

Info

ID:	206323
PubChem CID:	80231457
Reduced:	SN3C15H23 (1)
Stoich.:	AB3C15D23 (1)
Weight, g/mol:	271.233371
ΔH_f, kcal/mol:	35.09
Dipole, Da:	2.81
IP(EA), eV:	-8.66(0.04)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

2-[[(4,4-dimethylcyclohexyl)-methylamino]methyl]-3,3-dimethylbutane-1-thiol

Drug info:

PubChemData

Smile

CCC(CC)N1C=CC(=N1)CC(C2=CSC=C2C)N

DOS

IR

Vibrations