Geometry & MOs

Info

ID:	143055
PubChem CID:	53140533
Reduced:	N3O3C19H27 (1)
Stoich.:	A3B3C19D27 (1)
Weight, g/mol:	357.205242
ΔH_f, kcal/mol:	-97.05
Dipole, Da:	6.05
IP(EA), eV:	-8.17(0.12)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

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

Drug info:

PubChemData

Smile

COCCCNC(=O)N1CCC2=CN(C3=CC=CC(=C23)C1)CCOC

DOS

IR

Vibrations