Geometry & MOs

Info

ID:	349068
PubChem CID:	127274794
Reduced:	O2N5C21H27 (1)
Stoich.:	A2B5C21D27 (1)
Weight, g/mol:	268.124549
ΔH_f, kcal/mol:	-27.04
Dipole, Da:	4.44
IP(EA), eV:	-9.12(0.24)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

N-(1-cyanocyclobutyl)-2-(oxan-2-ylmethylsulfanyl)acetamide

Drug info:

PubChemData

Smile

CN(CC1=CC=CC=C1)C(=O)N2CCC(CC2)C(=O)N3CCC4=C(C3)C=NN4

DOS

IR

Vibrations