Geometry & MOs

Info

ID:	307693
PubChem CID:	125308131
Reduced:	O2N5C22H25 (1)
Stoich.:	A2B5C22D25 (1)
Weight, g/mol:	299.126991
ΔH_f, kcal/mol:	24.43
Dipole, Da:	4.85
IP(EA), eV:	-9.06(-1.52)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

2-methoxy-N-[(6S)-3-oxo-5,6,7,8-tetrahydro-4H-cinnolin-6-yl]benzamide

Drug info:

PubChemData

Smile

CC1=NC(=NC(=O)C1)N2C(=CC(=N2)C3CC3)NC(=O)C4=CC=C(C=C4)C(C)(C)C

DOS

IR

Vibrations