Geometry & MOs

Info

ID:	225331
PubChem CID:	85756483
Reduced:	FO2N3H12C16 (1)
Stoich.:	AB2C3D12E16 (1)
Weight, g/mol:	358.098524
ΔH_f, kcal/mol:	-44.24
Dipole, Da:	4.1
IP(EA), eV:	-8.92(-0.9)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

2-azido-5-chloro-N-phenyl-N-(3-phenylprop-2-ynyl)aniline

Drug info:

PubChemData

Smile

C1=CC(=CC(=C1)F)NC(=O)NC2=CC=C(C=C2)C3=CN=CO3

DOS

IR

Vibrations