Geometry & MOs

Info

ID:	247303
PubChem CID:	103069870
Reduced:	SN2C16H28 (1)
Stoich.:	AB2C16D28 (1)
Weight, g/mol:	188.098334
ΔH_f, kcal/mol:	7.52
Dipole, Da:	2.38
IP(EA), eV:	-8.66(-0.1)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

2-[(1-oxo-1,4-thiazinan-4-yl)methyl]prop-2-en-1-amine

Drug info:

PubChemData

Smile

CC(C)N(CC1=CC=CS1)CC(=C)CNC(C)(C)C

DOS

IR

Vibrations