Geometry & MOs

Info

ID:	185220
PubChem CID:	77271528
Reduced:	SN5O5H23C24 (1)
Stoich.:	AB5C5D23E24 (1)
Weight, g/mol:	398.194068
ΔH_f, kcal/mol:	-132.39
Dipole, Da:	7.21
IP(EA), eV:	-8.62(-1.32)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

7,8-bis(ethoxymethoxy)-6-methoxy-2-phenyl-4,4a,6,7,8,8a-hexahydropyrano[3,2-d][1,3]dioxine

Drug info:

PubChemData

Smile

C1C(OC(=O)N1C2=CC3=C(C=C2)SCC(=O)N3)CCNCC4(CN5C(=O)C=CC6=NC=CC4=C65)O

DOS

IR

Vibrations