Geometry & MOs

Info

ID:	249426
PubChem CID:	103089366
Reduced:	NSO2C10H19 (1)
Stoich.:	ABC2D10E19 (1)
Weight, g/mol:	245.108565
ΔH_f, kcal/mol:	-83.69
Dipole, Da:	2.11
IP(EA), eV:	-8.52(0.5)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

2-[acetyl(cyclopropyl)amino]-5-methylsulfanylpentanoic acid

Drug info:

PubChemData

Smile

COC(=O)C(CCCSC)NCC=C

DOS

IR

Vibrations