Geometry & MOs

Info

ID:	36167
PubChem CID:	7980840
Reduced:	N2O5H18C22 (1)
Stoich.:	A2B5C18D22 (1)
Weight, g/mol:	411.128214
ΔH_f, kcal/mol:	-49.72
Dipole, Da:	6.93
IP(EA), eV:	-8.52(-1.87)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

2-[(2S)-1-[4-(difluoromethoxy)phenyl]-1-oxopropan-2-yl]oxy-N-phenylbenzamide

Drug info:

PubChemData

Smile

CC1=C(C=C(C=C1)C(=O)COC2=CC=CC=C2C(=O)NC3=CC=CC=C3)[N+](=O)[O-]

DOS

IR

Vibrations