Geometry & MOs

Info

ID:	176529
PubChem CID:	76062989
Reduced:	NOC15H21 (1)
Stoich.:	ABC15D21 (1)
Weight, g/mol:	381.103479
ΔH_f, kcal/mol:	29.92
Dipole, Da:	2.64
IP(EA), eV:	-8.08(0.08)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

2-naphthalen-2-ylsulfanyl-2-(phenylmethoxycarbonylamino)propanoic acid

Drug info:

PubChemData

Smile

CC1CCC2C3C=CC=C(C3CCC2=N1)OC

DOS

IR

Vibrations