Geometry & MOs

Info

ID:	143054
PubChem CID:	53140532
Reduced:	O2N3C22H25 (1)
Stoich.:	A2B3C22D25 (1)
Weight, g/mol:	345.205242
ΔH_f, kcal/mol:	-23.0
Dipole, Da:	5.21
IP(EA), eV:	-8.33(-0.05)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

3-(2-methoxyethyl)-N-(3-methoxypropyl)-3,10-diazatricyclo[6.4.1.04,13]trideca-1,4,6,8(13)-tetraene-10-carboxamide

Drug info:

PubChemData

Smile

COCCN1C=C2CCN(CC3=C2C1=CC=C3)C(=O)NCC4=CC=CC=C4

DOS

IR

Vibrations