Geometry & MOs

Info

ID:	204384
PubChem CID:	79957485
Reduced:	NOSC15H23 (1)
Stoich.:	ABCD15E23 (1)
Weight, g/mol:	281.217721
ΔH_f, kcal/mol:	-43.17
Dipole, Da:	2.49
IP(EA), eV:	-8.63(0.38)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

5,5-dimethyl-N-(1,3,3-trimethyl-2-bicyclo[2.2.1]heptanyl)thian-3-amine

Drug info:

PubChemData

Smile

CCOC1=CC=CC(=C1)CNC2CCCSC2C

DOS

IR

Vibrations