Geometry & MOs

Info

ID:	342129
PubChem CID:	127264842
Reduced:	N2F3C14H19 (1)
Stoich.:	A2B3C14D19 (1)
Weight, g/mol:	284.116092
ΔH_f, kcal/mol:	-155.1
Dipole, Da:	2.1
IP(EA), eV:	-9.06(-0.05)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

[3-[3-(2-nitrophenyl)prop-2-enylamino]phenyl]methanol

Drug info:

PubChemData

Smile

CC1=C(C=CC=N1)CN2CCC(C2(C)C)C(F)(F)F

DOS

IR

Vibrations