Geometry & MOs

Info

ID:	354430
PubChem CID:	127286874
Reduced:	N3O4C20H27 (1)
Stoich.:	A3B4C20D27 (1)
Weight, g/mol:	365.224932
ΔH_f, kcal/mol:	-152.45
Dipole, Da:	6.54
IP(EA), eV:	-8.91(-0.28)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

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

Drug info:

PubChemData

Smile

C1CCC(CC1)(CNC(=O)N2CCC(=O)NCC2)C3=CC4=C(C=C3)OCO4

DOS

IR

Vibrations