Geometry & MOs

Info

ID:	396442
PubChem CID:	135028421
Reduced:	O2N3C21H22 (2)
Stoich.:	A2B3C21D22 (2)
Weight, g/mol:	161.058912
ΔH_f, kcal/mol:	84.14
Dipole, Da:	3.57
IP(EA), eV:	-9.47(-0.39)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

(Z)-2-azido-1-phenylethenol

Drug info:

PubChemData

Smile

C1=CC=C(C=C1)/C=C/C(N2N=NC(=C2)COCCOCCOCCOCC3=CN(N=N3)C(C4=CC=CC=C4)/C=C/C5=CC=CC=C5)C6=CC=CC=C6

DOS

IR

Vibrations