Geometry & MOs

Info

ID:	206406
PubChem CID:	80247060
Reduced:	SN2C16H28 (1)
Stoich.:	AB2C16D28 (1)
Weight, g/mol:	224.061949
ΔH_f, kcal/mol:	-8.1
Dipole, Da:	1.32
IP(EA), eV:	-8.46(0.08)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

1-[(3-methylthiophen-2-yl)methyl]-1,3-diazinane-2,4-dione

Drug info:

PubChemData

Smile

CCC1=C(SC=C1)CN2CC(NCC2C)(CC)CC

DOS

IR

Vibrations