Geometry & MOs

Info

ID:	287602
PubChem CID:	104248343
Reduced:	N2O4C15H22 (1)
Stoich.:	A2B4C15D22 (1)
Weight, g/mol:	239.090606
ΔH_f, kcal/mol:	-102.98
Dipole, Da:	7.04
IP(EA), eV:	-9.09(-1.53)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

methyl 3-(2,2-dimethylhydrazinyl)-4-nitrobenzoate

Drug info:

PubChemData

Smile

CC(C)CCCCNC1=C(C=CC(=C1)C(=O)OC)[N+](=O)[O-]

DOS

IR

Vibrations