Geometry & MOs

Info

ID:	276067
PubChem CID:	103820308
Reduced:	BrN2O2C9H11 (1)
Stoich.:	AB2C2D9E11 (1)
Weight, g/mol:	235.137242
ΔH_f, kcal/mol:	-67.4
Dipole, Da:	4.84
IP(EA), eV:	-10.14(-0.95)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

4-fluoro-2-methyl-N-[(1-methylcyclobutyl)methyl]benzamide

Drug info:

PubChemData

Smile

CC(CO)NC(=O)C1=CC(=NC=C1)Br

DOS

IR

Vibrations