Geometry & MOs

Info

ID:	272255
PubChem CID:	103736954
Reduced:	SN3C9H15 (1)
Stoich.:	AB3C9D15 (1)
Weight, g/mol:	238.111756
ΔH_f, kcal/mol:	28.6
Dipole, Da:	4.34
IP(EA), eV:	-8.91(-0.32)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

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

Drug info:

PubChemData

Smile

CC1=NSC(=N1)NCC2(CCC2)C

DOS

IR

Vibrations