Geometry & MOs

Info

ID:	350754
PubChem CID:	127279042
Reduced:	ON4C15H20 (1)
Stoich.:	AB4C15D20 (1)
Weight, g/mol:	238.113984
ΔH_f, kcal/mol:	-4.65
Dipole, Da:	4.16
IP(EA), eV:	-9.18(-0.73)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

(2,2-dimethylpyrrolidin-1-yl)-(2,4-dimethyl-1,3-thiazol-5-yl)methanone

Drug info:

PubChemData

Smile

CC1=NN2C(=C(C=NC2=C1)C(=O)N3CCCC3(C)C)C

DOS

IR

Vibrations