Geometry & MOs

Info

ID:	296077
PubChem CID:	117555005
Reduced:	O3N4C12H16 (1)
Stoich.:	A3B4C12D16 (1)
Weight, g/mol:	192.093249
ΔH_f, kcal/mol:	-64.34
Dipole, Da:	9.32
IP(EA), eV:	-9.17(-1.17)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

N-(3-methylbutyl)aziridine-1-sulfonamide

Drug info:

PubChemData

Smile

CC1=C(N2C(=N1)C=CC(=N2)NCCCOC)C(=O)O

DOS

IR

Vibrations