Geometry & MOs

Info

ID:	354587
PubChem CID:	127287201
Reduced:	O3N6C19H24 (1)
Stoich.:	A3B6C19D24 (1)
Weight, g/mol:	365.224932
ΔH_f, kcal/mol:	-79.03
Dipole, Da:	3.78
IP(EA), eV:	-8.62(-0.52)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

4-[2-(2,5-dimethylpyrrolidin-1-yl)ethyl]-N-[(4-methyl-1,3-thiazol-5-yl)methyl]piperazine-1-carboxamide

Drug info:

PubChemData

Smile

CC1C(=O)NC2=C(O1)C=CC(=C2)NC(=O)N[C@H](C)C3=NN=C4N3CCCCC4

DOS

IR

Vibrations