Geometry & MOs

Info

ID:	347063
PubChem CID:	127271567
Reduced:	O2N3C23H29 (1)
Stoich.:	A2B3C23D29 (1)
Weight, g/mol:	386.177647
ΔH_f, kcal/mol:	-45.84
Dipole, Da:	4.78
IP(EA), eV:	-9.4(0.0)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

4-(4-methyl-1,3-thiazol-2-yl)-N-[oxolan-2-yl(phenyl)methyl]piperazine-1-carboxamide

Drug info:

PubChemData

Smile

C1CCC(N(CC1)C(=O)NC(C2CCCO2)C3=CC=CC=C3)C4=CC=NC=C4

DOS

IR

Vibrations