Geometry & MOs

Info

ID:	257277
PubChem CID:	103144853
Reduced:	O2N3C16H23 (1)
Stoich.:	A2B3C16D23 (1)
Weight, g/mol:	292.102334
ΔH_f, kcal/mol:	-11.01
Dipole, Da:	8.22
IP(EA), eV:	-8.83(-0.8)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

N-[(2,5-difluorophenyl)methyl]-2,5-dimethyl-4-nitroaniline

Drug info:

PubChemData

Smile

CC1=CC(=C(C=C1[N+](=O)[O-])C)NC2CCN3CCCC3C2

DOS

IR

Vibrations