Geometry & MOs

Info

ID:	415657
PubChem CID:	135088656
Reduced:	N3O3C19H25 (1)
Stoich.:	A3B3C19D25 (1)
Weight, g/mol:	304.178693
ΔH_f, kcal/mol:	-65.37
Dipole, Da:	2.65
IP(EA), eV:	-8.87(-1.02)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

(2-methoxy-4-methylphenyl)-[(1S,5R)-9-methyl-3-oxa-7,9-diazabicyclo[3.3.2]decan-7-yl]methanone

Drug info:

PubChemData

Smile

CCC(CNC1=NOC(=C1C(=O)O)C2=CC=CC=C2)N3CCCCC3

DOS

IR

Vibrations