Geometry & MOs

Info

ID:	421462
PubChem CID:	135116051
Reduced:	NO4C24H37 (1)
Stoich.:	AB4C24D37 (1)
Weight, g/mol:	428.217203
ΔH_f, kcal/mol:	-215.31
Dipole, Da:	2.31
IP(EA), eV:	-8.74(0.37)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

(22S,23R)-23-methoxy-9-oxa-1,4,13,14,15,21-hexazatetracyclo[20.3.1.113,16.03,8]heptacosa-3(8),4,6,14,16(27)-pentaene-2,20-dione

Drug info:

PubChemData

Smile

CC1=CC(=C(C=C1)C(C)C)OC(C)(C)C(=O)N2CCC3(CC2)CC(CCO3)(C)O

DOS

IR

Vibrations