Geometry & MOs

Info

ID:	53499
PubChem CID:	14716375
Reduced:	SN2O4C6H10 (1)
Stoich.:	AB2C4D6E10 (1)
Weight, g/mol:	240.056863
ΔH_f, kcal/mol:	-181.2
Dipole, Da:	6.77
IP(EA), eV:	-9.45(-0.07)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

2-(phenylcarbamoylamino)-3-sulfanylpropanoic acid

Drug info:

PubChemData

Smile

C(C(C(=O)O)NC(=O)CC(=O)N)S

DOS

IR

Vibrations