Geometry & MOs

Info

ID:	26995
PubChem CID:	810313
Reduced:	SO2N3C18H19 (1)
Stoich.:	AB2C3D18E19 (1)
Weight, g/mol:	259.157229
ΔH_f, kcal/mol:	-36.79
Dipole, Da:	4.0
IP(EA), eV:	-8.54(-0.56)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

6,7-dimethoxyspiro[4H-isoquinoline-3,1'-cyclohexane]

Drug info:

PubChemData

Smile

CC1=CC=C(C=C1)NC(=O)C2=C(N(C(=O)N[C@@H]2C3=CC=CS3)C)C

DOS

IR

Vibrations