Geometry & MOs

Info

ID:	356111
PubChem CID:	127291147
Reduced:	N2O2C15H20 (1)
Stoich.:	A2B2C15D20 (1)
Weight, g/mol:	260.152478
ΔH_f, kcal/mol:	-79.74
Dipole, Da:	1.91
IP(EA), eV:	-8.49(0.16)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

N-(oxan-3-yl)-3,4-dihydro-1H-isoquinoline-2-carboxamide

Drug info:

PubChemData

Smile

CC1CC2=CC=CC=C2N1C(=O)NC3CCCOC3

DOS

IR

Vibrations