Geometry & MOs

Info

ID:	352644
PubChem CID:	127283733
Reduced:	OS2N4C19H20 (1)
Stoich.:	AB2C4D19E20 (1)
Weight, g/mol:	299.163377
ΔH_f, kcal/mol:	53.0
Dipole, Da:	6.78
IP(EA), eV:	-8.61(-1.2)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

N-(1-cyanocyclobutyl)-3-(morpholin-4-ylmethyl)benzamide

Drug info:

PubChemData

Smile

C1CCC2=C(C1)C3=C(N=C(N=C3S2)C4=CN=CC=C4)N5CCS(=O)CC5

DOS

IR

Vibrations