Geometry & MOs

Info

ID:	378589
PubChem CID:	134224680
Reduced:	NOH17C30 (1)
Stoich.:	ABC17D30 (1)
Weight, g/mol:	357.115364
ΔH_f, kcal/mol:	97.62
Dipole, Da:	2.23
IP(EA), eV:	-8.16(-1.06)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

14-oxa-28-azaheptacyclo[15.11.0.03,15.04,13.07,12.018,27.021,26]octacosa-1(17),2,4(13),5,7,9,11,15,18(27),19,21,23,25-tridecaene

Drug info:

PubChemData

Smile

C1=CC=C2C(=C1)C=CC3=C2C4=C(C=C3)C5=CC6=C(C=C5O4)C7=C(N6)C=CC8=CC=CC=C87

DOS

IR

Vibrations