Geometry & MOs

Info

ID:	377884
PubChem CID:	134223950
Reduced:	NO3C11H15 (2)
Stoich.:	AB3C11D15 (2)
Weight, g/mol:	430.210387
ΔH_f, kcal/mol:	-222.61
Dipole, Da:	12.69
IP(EA), eV:	-8.94(-0.91)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

2-methoxy-3-(3-methoxypropoxy)-5-methyl-11-oxo-7-propan-2-yl-6,7-dihydropyrido[1,2-d][1,4]benzodiazepine-10-carboxylic acid

Drug info:

PubChemData

Smile

CC(C)NCCC1=CC(=C(C=C1C2=CC(=O)C(=CN2)C(=O)O)OC)OCCCOC

DOS

IR

Vibrations