Geometry & MOs

Info

ID:	363517
PubChem CID:	127311596
Reduced:	FO2N4C20H21 (1)
Stoich.:	AB2C4D20E21 (1)
Weight, g/mol:	328.189926
ΔH_f, kcal/mol:	-59.21
Dipole, Da:	4.88
IP(EA), eV:	-8.71(-0.4)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

N-(cyclobutylmethyl)-4-(5-methyl-1,3-benzoxazol-2-yl)piperazine-1-carboxamide

Drug info:

PubChemData

Smile

CC1=CC2=C(C=C1)OC(=N2)N3CCN(CC3)C(=O)NCC4=CC(=CC=C4)F

DOS

IR

Vibrations