Geometry & MOs

Info

ID:	189074
PubChem CID:	77812079
Reduced:	NO3C23H31 (1)
Stoich.:	AB3C23D31 (1)
Weight, g/mol:	489.251523
ΔH_f, kcal/mol:	-150.69
Dipole, Da:	5.38
IP(EA), eV:	-8.97(-0.44)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

20-hydroxy-5-(2-methoxyphenyl)-13,14,18,18-tetramethyl-2-oxa-6-azapentacyclo[11.8.0.01,17.03,11.04,8]henicosa-3(11),4(8),9-triene-7,19-dione

Drug info:

PubChemData

Smile

CC1CCC2C(C(CCC23C1(CC4=C(O3)C5=C(C=C4)C(=O)NC5)C)O)(C)C

DOS

IR

Vibrations