Geometry & MOs

Info

ID:	269869
PubChem CID:	103619496
Reduced:	NOF2C17H27 (1)
Stoich.:	ABC2D17E27 (1)
Weight, g/mol:	372.00832
ΔH_f, kcal/mol:	-159.9
Dipole, Da:	4.57
IP(EA), eV:	-9.44(-0.36)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

N-(3-imidazol-1-ylpropyl)-3-iodo-4-nitroaniline

Drug info:

PubChemData

Smile

CC(C)CCCCCCNCC(C1=C(C=C(C=C1)F)F)O

DOS

IR

Vibrations