Geometry & MOs

Info

ID:	310201
PubChem CID:	126576545
Reduced:	ON3H25C33 (1)
Stoich.:	AB3C25D33 (1)
Weight, g/mol:	390.230728
ΔH_f, kcal/mol:	91.81
Dipole, Da:	3.46
IP(EA), eV:	-8.38(-0.74)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

4-[5-(4-methyl-3-morpholin-4-ylcyclohexa-1,5-dien-1-yl)naphthalen-2-yl]morpholine

Drug info:

PubChemData

Smile

CCNC(=O)C1=CC(=CC(=C1)N2C3=CC=CC=C3C4=CC=CC=C42)N5C6=CC=CC=C6C7=CC=CC=C75

DOS

IR

Vibrations