Geometry & MOs

Info

ID:	37
PubChem CID:	1994
Reduced:	NSO3C20H33 (1)
Stoich.:	ABC3D20E33 (1)
Weight, g/mol:	367.218115
ΔH_f, kcal/mol:	-157.27
Dipole, Da:	6.56
IP(EA), eV:	-9.01(0.0)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

2-acetamido-3-(3,7,11-trimethyldodeca-2,6,10-trienylsulfanyl)propanoic acid

Drug info:

PubChemData

Smile

CC(=CCCC(=CCCC(=CCSCC(C(=O)O)NC(=O)C)C)C)C

DOS

IR

Vibrations