Geometry & MOs

Info

ID:	358579
PubChem CID:	127296338
Reduced:	O2N3C23H33 (1)
Stoich.:	A2B3C23D33 (1)
Weight, g/mol:	396.216141
ΔH_f, kcal/mol:	-72.2
Dipole, Da:	2.11
IP(EA), eV:	-9.12(0.36)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

N-(5-methyl-1,2-oxazol-3-yl)-2-[4-[2-(1,2,3,4-tetrahydronaphthalen-1-yl)acetyl]piperazin-1-yl]acetamide

Drug info:

PubChemData

Smile

C1CC(CCC1CC(=O)N2CCN(CC2)CC(=O)NC3CC3)C4=CC=CC=C4

DOS

IR

Vibrations