Geometry & MOs

Info

ID:	343391
PubChem CID:	127266564
Reduced:	BrO2N3C14H20 (1)
Stoich.:	AB2C3D14E20 (1)
Weight, g/mol:	345.205242
ΔH_f, kcal/mol:	-70.68
Dipole, Da:	2.44
IP(EA), eV:	-8.28(0.07)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

2-[4-[(1-cyclobutylcyclobutyl)carbamoylamino]phenoxy]-N-ethylacetamide

Drug info:

PubChemData

Smile

CCN(C)C(=O)NC1=C(C=CC(=C1)N2CCOCC2)Br

DOS

IR

Vibrations