Geometry & MOs

Info

ID:	365385
PubChem CID:	127317784
Reduced:	SN3O4C18H27 (1)
Stoich.:	AB3C4D18E27 (1)
Weight, g/mol:	368.14601
ΔH_f, kcal/mol:	-170.27
Dipole, Da:	2.72
IP(EA), eV:	-9.27(-0.62)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

4-cyclobutyl-N-[2-(trifluoromethyl)-1,3-benzoxazol-5-yl]piperazine-1-carboxamide

Drug info:

PubChemData

Smile

CC1(CCOC1)CNC(=O)NC2=CC=CC=C2S(=O)(=O)N3CCCCC3

DOS

IR

Vibrations