Geometry & MOs

Info

ID:	399125
PubChem CID:	135038033
Reduced:	O2C8H11 (2)
Stoich.:	A2B8C11 (2)
Weight, g/mol:	323.122501
ΔH_f, kcal/mol:	-174.31
Dipole, Da:	4.94
IP(EA), eV:	-9.64(0.06)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

ethyl 2-[(2-methylpropan-2-yl)oxycarbonylamino]-3-(propyldisulfanyl)propanoate

Drug info:

PubChemData

Smile

CC1([C@H](CC(O1)O)C(=O)CCOCC2=CC=CC=C2)C

DOS

IR

Vibrations