Geometry & MOs

Info

ID:	250010
PubChem CID:	103093500
Reduced:	NOC18H23 (1)
Stoich.:	ABC18D23 (1)
Weight, g/mol:	218.178299
ΔH_f, kcal/mol:	-8.54
Dipole, Da:	1.78
IP(EA), eV:	-8.25(-0.35)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

(E)-3-methyl-4-(4-methylpyridin-3-yl)-N-propylbut-3-en-2-amine

Drug info:

PubChemData

Smile

CCNC(C)/C(=C/C1=CC2=C(C=C1)C=C(C=C2)OC)/C

DOS

IR

Vibrations