Geometry & MOs

Info

ID:	204360
PubChem CID:	79954002
Reduced:	SN2C18H30 (1)
Stoich.:	AB2C18D30 (1)
Weight, g/mol:	304.19732
ΔH_f, kcal/mol:	-2.07
Dipole, Da:	2.38
IP(EA), eV:	-8.04(0.48)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

[5,5-dimethyl-3-(2,3,4,5-tetrahydro-1-benzazepin-1-yl)thian-3-yl]methanamine

Drug info:

PubChemData

Smile

CCCCN(C1=CC=CC=C1)C2(CC(CSC2)(C)C)CN

DOS

IR

Vibrations