Geometry & MOs

Info

ID:	36844
PubChem CID:	8013672
Reduced:	NO6C14H19 (1)
Stoich.:	AB6C14D19 (1)
Weight, g/mol:	378.179087
ΔH_f, kcal/mol:	-222.58
Dipole, Da:	3.58
IP(EA), eV:	-8.67(-0.08)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

[2-[[(2R)-2-cyano-3-methylbutan-2-yl]amino]-2-oxoethyl] 2-(3,4,5-trimethoxyphenyl)acetate

Drug info:

PubChemData

Smile

CNC(=O)COC(=O)CC1=CC(=C(C(=C1)OC)OC)OC

DOS

IR

Vibrations