Geometry & MOs

Info

ID:	5507
PubChem CID:	13248
Reduced:	OSN2C10H16 (1)
Stoich.:	ABC2D10E16 (1)
Weight, g/mol:	212.098334
ΔH_f, kcal/mol:	-19.56
Dipole, Da:	1.86
IP(EA), eV:	-9.51(-0.59)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

4-(2-methylpropyl)-1-prop-2-enyl-2-sulfanyl-4H-imidazol-5-one

Drug info:

PubChemData

Smile

CC(C)CC1C(=O)N(C(=N1)S)CC=C

DOS

IR

Vibrations