Geometry & MOs

Info

ID:	383350
PubChem CID:	134975024
Reduced:	ClNSC10H18 (1)
Stoich.:	ABCD10E18 (1)
Weight, g/mol:	168.162649
ΔH_f, kcal/mol:	-35.2
Dipole, Da:	2.38
IP(EA), eV:	-8.49(0.18)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

(1S,2S)-2,3,7-trimethyl-3,7-diazabicyclo[3.3.1]nonane

Drug info:

PubChemData

Smile

CC(C)(C)S/N=C/1\CCCCC1Cl

DOS

IR

Vibrations