Geometry & MOs

Info

ID:	417156
PubChem CID:	135091539
Reduced:	O2N4C13H24 (1)
Stoich.:	A2B4C13D24 (1)
Weight, g/mol:	531.236936
ΔH_f, kcal/mol:	-71.4
Dipole, Da:	6.38
IP(EA), eV:	-9.03(0.21)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

5,6-dimethoxy-14-(2-pyridin-3-ylacetyl)-17,20-dioxa-11,14-diazatetracyclo[19.2.2.02,11.03,8]pentacosa-1(23),3,5,7,21,24-hexaen-12-one

Drug info:

PubChemData

Smile

CCN(C)CC(C)C(=O)N(CCO)CC1=NC=CN1

DOS

IR

Vibrations