Geometry & MOs

Info

ID:	33134
PubChem CID:	7885089
Reduced:	N2O5C24H26 (1)
Stoich.:	A2B5C24D26 (1)
Weight, g/mol:	359.184506
ΔH_f, kcal/mol:	-152.27
Dipole, Da:	9.75
IP(EA), eV:	-8.96(-0.19)
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-dimethylbenzoyl)amino]acetate

Drug info:

PubChemData

Smile

CC1=C(C=C(C=C1)C(=O)NCC(=O)OCC(=O)C2=C(N(C(=C2)C)CC3=CC=CO3)C)C

DOS

IR

Vibrations