Geometry & MOs

Info

ID:	63912
PubChem CID:	26759464
Reduced:	SN2O6C18H20 (1)
Stoich.:	AB2C6D18E20 (1)
Weight, g/mol:	392.104208
ΔH_f, kcal/mol:	-212.47
Dipole, Da:	5.6
IP(EA), eV:	-8.41(-0.72)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

[(2R)-1-[(3-carbamoylthiophen-2-yl)amino]-1-oxopropan-2-yl] 2-(3,4-dimethoxyphenyl)acetate

Drug info:

PubChemData

Smile

C[C@@H](C(=O)NC1=C(C=CS1)C(=O)N)OC(=O)CC2=CC(=C(C=C2)OC)OC

DOS

IR

Vibrations