Geometry & MOs

Info

ID:	312602
PubChem CID:	126606750
Reduced:	NO4C18H23 (1)
Stoich.:	AB4C18D23 (1)
Weight, g/mol:	306.125594
ΔH_f, kcal/mol:	-114.82
Dipole, Da:	4.16
IP(EA), eV:	-8.39(-0.54)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

(4-methoxycyclohepta-1,3,6-trien-1-yl)-(1-methoxynaphthalen-2-yl)methanone

Drug info:

PubChemData

Smile

CC(C)C1=C2C=C(C=C(C2=CC(=C1OC)OC)OC)C(=N)OC

DOS

IR

Vibrations