Geometry & MOs

Info

ID:	437615
PubChem CID:	135226722
Reduced:	N2C7H14 (1)
Stoich.:	A2B7C14 (1)
Weight, g/mol:	165.15175
ΔH_f, kcal/mol:	18.44
Dipole, Da:	2.99
IP(EA), eV:	-8.32(2.56)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

2,6-dimethyl-3,4,4a,5,8,8a-hexahydro-1H-isoquinoline

Drug info:

PubChemData

Smile

CN1CCCC2C1NC2

DOS

IR

Vibrations