Geometry & MOs

Info

ID:	410037
PubChem CID:	135082826
Reduced:	BC18H35 (1)
Stoich.:	AB18C35 (1)
Weight, g/mol:	204.020478
ΔH_f, kcal/mol:	-65.49
Dipole, Da:	0.28
IP(EA), eV:	-9.1(0.54)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

1-methylsulfonyl-3-(oxomethylidene)-1-prop-2-enylurea

Drug info:

PubChemData

Smile

B(C/1CCCCC/C=C1)(C(C)C(C)C)C(C)C(C)C

DOS

IR

Vibrations