Geometry & MOs

Info

ID:	392294
PubChem CID:	135014248
Reduced:	NO3H27C30 (1)
Stoich.:	AB3C27D30 (1)
Weight, g/mol:	622.405352
ΔH_f, kcal/mol:	12.85
Dipole, Da:	4.95
IP(EA), eV:	-8.72(-0.7)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

(3E,5R,6S,7R,18S)-18-methyl-6,7-bis(phenylmethoxy)-5-triethylsilyloxy-1-oxacyclooctadec-3-en-2-one

Drug info:

PubChemData

Smile

CCOC(C)OC1=C(C=CC2=CC=CC=C21)N(CC3=CC=CC=C3)C(=O)C#CC4=CC=CC=C4

DOS

IR

Vibrations