Geometry & MOs

Info

ID:	172458
PubChem CID:	75512587
Reduced:	OSN3C18H35 (1)
Stoich.:	ABC3D18E35 (1)
Weight, g/mol:	276.084097
ΔH_f, kcal/mol:	-111.98
Dipole, Da:	3.93
IP(EA), eV:	-8.43(0.83)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

2-(1-aminocyclobutyl)-N-(3,5-difluorophenyl)acetamide;hydrochloride

Drug info:

PubChemData

Smile

CCSC1CCCCC1NC(=O)NC2CC(NC(C2)(C)C)(C)C

DOS

IR

Vibrations