Geometry & MOs

Info

ID:	247228
PubChem CID:	103068880
Reduced:	N2C13H28 (1)
Stoich.:	A2B13C28 (1)
Weight, g/mol:	202.146999
ΔH_f, kcal/mol:	-18.36
Dipole, Da:	2.16
IP(EA), eV:	-8.61(1.32)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

2-(3,4-dihydro-1H-isoquinolin-2-ylmethyl)prop-2-en-1-amine

Drug info:

PubChemData

Smile

CCCNCC(=C)CN(CCC)CCC

DOS

IR

Vibrations