Geometry & MOs

Info

ID:	124850
PubChem CID:	50899462
Reduced:	N4O7H10C14 (1)
Stoich.:	A4B7C10D14 (1)
Weight, g/mol:	270.07316
ΔH_f, kcal/mol:	-12.5
Dipole, Da:	9.11
IP(EA), eV:	-8.94(-2.52)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

N'-(2-methyl-1-phenylpropyl)ethanimidamide;hydrobromide

Drug info:

PubChemData

Smile

CC1=N/C(=C/2\C=C(C(=O)C(=C2C(=O)C3=CC=NO3)[N+](=O)[O-])OC)/NO1

DOS

IR

Vibrations