Geometry & MOs

Info

ID:	266399
PubChem CID:	103564712
Reduced:	OSN2C11H14 (1)
Stoich.:	ABC2D11E14 (1)
Weight, g/mol:	269.04153
ΔH_f, kcal/mol:	2.83
Dipole, Da:	3.93
IP(EA), eV:	-8.9(-0.64)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

[1-(4-bromoanilino)-3-methylcyclobutyl]methanol

Drug info:

PubChemData

Smile

CC1CC(C1)(CC2=CN3C=CSC3=N2)O

DOS

IR

Vibrations