Geometry & MOs

Info

ID:	350784
PubChem CID:	127279072
Reduced:	N3O3C13H21 (1)
Stoich.:	A3B3C13D21 (1)
Weight, g/mol:	243.048463
ΔH_f, kcal/mol:	-157.29
Dipole, Da:	4.94
IP(EA), eV:	-9.31(-0.01)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

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

Drug info:

PubChemData

Smile

CC1(CCCN1C(=O)CN2C(=O)C(NC2=O)(C)C)C

DOS

IR

Vibrations