Geometry & MOs

Info

ID:	163260
PubChem CID:	57665436
Reduced:	NO4C9H15 (1)
Stoich.:	AB4C9D15 (1)
Weight, g/mol:	509.151798
ΔH_f, kcal/mol:	-182.06
Dipole, Da:	6.42
IP(EA), eV:	-9.44(-0.11)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

tert-butyl N-[(2S)-1-[4-[(2,4-dichlorophenyl)sulfonylamino]butylamino]-4-methyl-1-oxopentan-2-yl]carbamate

Drug info:

PubChemData

Smile

C1CCN(CC1)CC(=O)OCC(=O)O

DOS

IR

Vibrations