Geometry & MOs

Info

ID:	70435
PubChem CID:	48413345
Reduced:	SN2O5C17H22 (1)
Stoich.:	AB2C5D17E22 (1)
Weight, g/mol:	359.115107
ΔH_f, kcal/mol:	-188.37
Dipole, Da:	4.34
IP(EA), eV:	-9.46(-0.95)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

ethyl 3-[cyclopropyl-(1,3-dimethyl-2,4-dioxopyrimidin-5-yl)sulfonylamino]propanoate

Drug info:

PubChemData

Smile

CCOC(=O)CCN(C1CC1)S(=O)(=O)C2=CC3=C(C=C2)NC(=O)CC3

DOS

IR

Vibrations