Geometry & MOs

Info

ID:	390153
PubChem CID:	134997405
Reduced:	N2O3C15H20 (1)
Stoich.:	A2B3C15D20 (1)
Weight, g/mol:	358.131742
ΔH_f, kcal/mol:	-79.4
Dipole, Da:	1.3
IP(EA), eV:	-9.09(0.24)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

N-benzyl-N-[1-(2-nitrophenyl)-3-phenylprop-2-ynyl]hydroxylamine

Drug info:

PubChemData

Smile

CC1=CC(=C(C(=C1)C)C2N=C(ON2C)CC(=O)OC)C

DOS

IR

Vibrations