Geometry & MOs

Info

ID:	294174
PubChem CID:	117430723
Reduced:	N3O3H13C14 (1)
Stoich.:	A3B3C13D14 (1)
Weight, g/mol:	271.138385
ΔH_f, kcal/mol:	-64.02
Dipole, Da:	8.05
IP(EA), eV:	-8.7(-0.79)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

1-[2-(1,1-difluoroethyl)-4,5-dimethoxyphenyl]cyclobutan-1-amine

Drug info:

PubChemData

Smile

CC(=O)N1CCC2=C1C=C(C=C2)C3=NNC(=C3)C(=O)O

DOS

IR

Vibrations