Geometry & MOs

Info

ID:	148157
PubChem CID:	53787819
Reduced:	O4C9H18 (1)
Stoich.:	A4B9C18 (1)
Weight, g/mol:	202.110613
ΔH_f, kcal/mol:	-216.96
Dipole, Da:	6.99
IP(EA), eV:	-10.57(0.9)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

6-(dimethylaminomethylidene)-7,8-dihydroisoquinolin-5-one

Drug info:

PubChemData

Smile

CCCC(CC(C(C)C(=O)O)O)O

DOS

IR

Vibrations