Geometry & MOs

Info

ID:	294181
PubChem CID:	117431619
Reduced:	N5C15H21 (1)
Stoich.:	A5B15C21 (1)
Weight, g/mol:	271.070071
ΔH_f, kcal/mol:	76.93
Dipole, Da:	2.5
IP(EA), eV:	-8.72(-0.37)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

1-(4-methylsulfanyl-3-methylsulfonylphenyl)cyclobutan-1-amine

Drug info:

PubChemData

Smile

CC1=NN(N=C1)C2=CC=CC(=C2)C3CC(CN3C)CN

DOS

IR

Vibrations