Geometry & MOs

Info

ID:	386685
PubChem CID:	134982532
Reduced:	PC13H13 (2)
Stoich.:	AB13C13 (2)
Weight, g/mol:	344.141245
ΔH_f, kcal/mol:	74.0
Dipole, Da:	0.54
IP(EA), eV:	-8.52(-0.1)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

(2Z)-7-methoxy-9,18-dioxatetracyclo[17.3.1.14,8.011,16]tetracosa-1(23),2,4(24),5,7,11,13,15,19,21-decaene

Drug info:

PubChemData

Smile

CC1=CPC(=C1C)/C(=C(\C2=CC=CC=C2)/C3=C(C(=CP3)C)C)/C4=CC=CC=C4

DOS

IR

Vibrations