Geometry & MOs

Info

ID:	350718
PubChem CID:	127279006
Reduced:	SN2O2C13H22 (1)
Stoich.:	AB2C2D13E22 (1)
Weight, g/mol:	259.157229
ΔH_f, kcal/mol:	-109.14
Dipole, Da:	7.86
IP(EA), eV:	-8.82(0.15)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

3,4-dihydro-2H-chromen-4-yl-(2,2-dimethylpyrrolidin-1-yl)methanone

Drug info:

PubChemData

Smile

CCC(=O)N1CSCC1C(=O)N2CCCC2(C)C

DOS

IR

Vibrations