Geometry & MOs

Info

ID:	220635
PubChem CID:	85198116
Reduced:	NO6H17C18 (1)
Stoich.:	AB6C17D18 (1)
Weight, g/mol:	343.105587
ΔH_f, kcal/mol:	-200.76
Dipole, Da:	8.68
IP(EA), eV:	-9.74(-1.61)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

methyl 11,17-dioxo-5,7-dioxa-12-azapentacyclo[10.6.1.02,10.04,8.015,19]nonadeca-2,4(8),9-triene-15-carboxylate

Drug info:

PubChemData

Smile

CC(C)CC(C(=O)O)NC(=O)C1=CC2=C(O1)C=CC3=C2OC(=O)C=C3

DOS

IR

Vibrations