Geometry & MOs

Info

ID:	367369
PubChem CID:	127324321
Reduced:	O2N4C19H32 (1)
Stoich.:	A2B4C19D32 (1)
Weight, g/mol:	336.216141
ΔH_f, kcal/mol:	-96.58
Dipole, Da:	4.43
IP(EA), eV:	-8.71(0.24)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

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

Drug info:

PubChemData

Smile

CC1CCC(C(C1)C)NC(=O)N2CCN(CC2)CC3=NC(=C(O3)C)C

DOS

IR

Vibrations