Geometry & MOs

Info

ID:	249719
PubChem CID:	103091573
Reduced:	FNOC14H14 (1)
Stoich.:	ABCD14E14 (1)
Weight, g/mol:	197.101606
ΔH_f, kcal/mol:	-27.15
Dipole, Da:	2.03
IP(EA), eV:	-8.61(-0.78)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

(E)-4-[3-(difluoromethyl)phenyl]but-3-en-2-amine

Drug info:

PubChemData

Smile

CC(/C=C/C1=CC=C(O1)C2=CC=CC=C2F)N

DOS

IR

Vibrations