Geometry & MOs

Info

ID:	275789
PubChem CID:	103817775
Reduced:	FN3C14H18 (1)
Stoich.:	AB3C14D18 (1)
Weight, g/mol:	303.068255
ΔH_f, kcal/mol:	-5.85
Dipole, Da:	3.73
IP(EA), eV:	-8.22(0.32)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

4-(difluoromethoxy)-N-[(2,4,5-trifluorophenyl)methyl]aniline

Drug info:

PubChemData

Smile

CC1=C(C=C(C=C1)NCC2=CN(N=C2)C(C)C)F

DOS

IR

Vibrations