Geometry & MOs

Info

ID:	33129
PubChem CID:	7885072
Reduced:	N2O4C25H32 (1)
Stoich.:	A2B4C25D32 (1)
Weight, g/mol:	405.138779
ΔH_f, kcal/mol:	-164.88
Dipole, Da:	3.9
IP(EA), eV:	-9.31(-0.22)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

[(2S)-1-[4-(difluoromethoxy)phenyl]-1-oxopropan-2-yl] 2-[(3,4-dimethylbenzoyl)amino]acetate

Drug info:

PubChemData

Smile

CC1=C(C=C(C=C1)C(=O)NCC(=O)OCC(=O)NC2=C(C=CC=C2C(C)C)C(C)C)C

DOS

IR

Vibrations