Geometry & MOs

Info

ID:	250042
PubChem CID:	103093765
Reduced:	NF3C15H20 (1)
Stoich.:	AB3C15D20 (1)
Weight, g/mol:	247.193614
ΔH_f, kcal/mol:	-152.55
Dipole, Da:	4.52
IP(EA), eV:	-9.12(-0.43)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

(E)-4-[4-(methoxymethyl)phenyl]-3-methyl-N-propylbut-3-en-2-amine

Drug info:

PubChemData

Smile

CCCNC(C)/C(=C/C1=CC(=CC=C1)C(F)(F)F)/C

DOS

IR

Vibrations