Geometry & MOs

Info

ID:	249940
PubChem CID:	103093006
Reduced:	NF2O2C15H21 (1)
Stoich.:	AB2C2D15E21 (1)
Weight, g/mol:	193.126678
ΔH_f, kcal/mol:	-172.62
Dipole, Da:	6.17
IP(EA), eV:	-8.86(-0.07)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

(E)-4-(4-fluorophenyl)-N,3-dimethylbut-3-en-2-amine

Drug info:

PubChemData

Smile

CCOC1=C(C=CC(=C1)/C=C(/C)\C(C)NC)OC(F)F

DOS

IR

Vibrations