Geometry & MOs

Info

ID:	908
PubChem CID:	3514
Reduced:	SN4O7C10H16 (1)
Stoich.:	AB4C7D10E16 (1)
Weight, g/mol:	336.07397
ΔH_f, kcal/mol:	-257.29
Dipole, Da:	2.84
IP(EA), eV:	-9.62(-1.48)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

2-amino-5-[[1-(carboxymethylamino)-3-nitrososulfanyl-1-oxopropan-2-yl]amino]-5-oxopentanoic acid

Drug info:

PubChemData

Smile

C(CC(=O)NC(CSN=O)C(=O)NCC(=O)O)C(C(=O)O)N

DOS

IR

Vibrations