Geometry & MOs

Info

ID:	398966
PubChem CID:	135036645
Reduced:	NO4C12H12 (1)
Stoich.:	AB4C12D12 (1)
Weight, g/mol:	241.222577
ΔH_f, kcal/mol:	-120.8
Dipole, Da:	7.89
IP(EA), eV:	0.0(0.0)
Spin(S_z, S²):	0.500000, 1.058638
Charge, e:	0

Chem-info

IUPAC name:

(1-butan-2-yl-3-pentylaziridin-2-yl)-trimethylsilane

Drug info:

PubChemData

Smile

CC1=CC=CC=C1NC(=O)C(C(=O)C)C(=O)[O-]

DOS

IR

Vibrations