Geometry & MOs

Info

ID:	191592
PubChem CID:	78165494
Reduced:	N3O3C19H21 (1)
Stoich.:	A3B3C19D21 (1)
Weight, g/mol:	628.232185
ΔH_f, kcal/mol:	-84.25
Dipole, Da:	6.57
IP(EA), eV:	-9.0(-0.28)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

None

Drug info:

PubChemData

Smile

CCOC(=O)C1CCC2C(C1)NC(=O)C3=CC(=CN23)C4=CN=CC=C4

DOS

IR

Vibrations