Geometry & MOs

Info

ID:	208049
PubChem CID:	80485739
Reduced:	N3C14H17 (1)
Stoich.:	A3B14C17 (1)
Weight, g/mol:	253.11365
ΔH_f, kcal/mol:	58.72
Dipole, Da:	6.46
IP(EA), eV:	-8.64(-0.37)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

N-(cyclobutylmethyl)-2-methyl-5-methylsulfonylaniline

Drug info:

PubChemData

Smile

C1CC(C1)CNC2=CC(=CC=C2)N3C=CN=C3

DOS

IR

Vibrations