Geometry & MOs

Info

ID:	293863
PubChem CID:	117407372
Reduced:	NO3C15H19 (1)
Stoich.:	AB3C15D19 (1)
Weight, g/mol:	261.136493
ΔH_f, kcal/mol:	-124.85
Dipole, Da:	5.18
IP(EA), eV:	-8.94(-0.08)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

1-(2,3,4,7,8,9-hexahydropyrano[2,3-g]chromen-5-yl)-2-(methylamino)ethanone

Drug info:

PubChemData

Smile

CC1CCC2=C(C=CC=C2O1)C3CC(CN3)C(=O)O

DOS

IR

Vibrations