Geometry & MOs

Info

ID:	122605
PubChem CID:	50814155
Reduced:	N3O4H25C26 (1)
Stoich.:	A3B4C25D26 (1)
Weight, g/mol:	497.195071
ΔH_f, kcal/mol:	-83.89
Dipole, Da:	6.39
IP(EA), eV:	-8.17(-0.45)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

2-[4-(3,4-dihydro-1H-isoquinoline-2-carbonyl)-2-oxoquinolin-1-yl]-N-(3,4-dimethoxyphenyl)acetamide

Drug info:

PubChemData

Smile

C1CN(C(=O)N(C1)C2=CC=CC(=C2)C(=O)NC3=CC4=C(C=C3)OCCO4)CC5=CC=CC=C5

DOS

IR

Vibrations