Geometry & MOs

Info

ID:	367372
PubChem CID:	127324324
Reduced:	O2N3C14H25 (1)
Stoich.:	A2B3C14D25 (1)
Weight, g/mol:	352.193297
ΔH_f, kcal/mol:	-89.22
Dipole, Da:	1.98
IP(EA), eV:	-8.93(1.21)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

4-[(4,5-dimethyl-1,3-oxazol-2-yl)methyl]-N-(thian-4-ylmethyl)piperazine-1-carboxamide

Drug info:

PubChemData

Smile

CC1(CCOC1)CNC(=O)NC2CCN(C2)C3CC3

DOS

IR

Vibrations