Geometry & MOs

Info

ID:	249902
PubChem CID:	103092770
Reduced:	NOC11H17 (1)
Stoich.:	ABC11D17 (1)
Weight, g/mol:	203.1674
ΔH_f, kcal/mol:	-13.04
Dipole, Da:	1.52
IP(EA), eV:	-8.94(0.13)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

(E)-4-(4-methylphenyl)-N-propylbut-3-en-2-amine

Drug info:

PubChemData

Smile

CCCNC(C)/C=C/C1=COC=C1

DOS

IR

Vibrations