Geometry & MOs

Info

ID:	350786
PubChem CID:	127279074
Reduced:	NOSC12H17 (1)
Stoich.:	ABCD12E17 (1)
Weight, g/mol:	223.103085
ΔH_f, kcal/mol:	-41.35
Dipole, Da:	4.68
IP(EA), eV:	-8.96(-0.31)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

(2,2-dimethylpyrrolidin-1-yl)-(5-methylthiophen-2-yl)methanone

Drug info:

PubChemData

Smile

CC1=C(SC=C1)C(=O)N2CCCC2(C)C

DOS

IR

Vibrations