Geometry & MOs

Info

ID:	190726
PubChem CID:	78049263
Reduced:	NOC5H6 (4)
Stoich.:	ABC5D6 (4)
Weight, g/mol:	312.147393
ΔH_f, kcal/mol:	-127.76
Dipole, Da:	15.45
IP(EA), eV:	-8.62(-0.98)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

14-(dimethylamino)-4-oxo-3-azatricyclo[10.4.0.02,7]hexadeca-1(12),2,6,13,15-pentaene-5-carboxylic acid

Drug info:

PubChemData

Smile

CN(C)C1CCN(C1)C2=CC3=C(C=C2)C4=C(CCN3)C(=O)C(C(=O)N4)C(=O)O

DOS

IR

Vibrations