Geometry & MOs

Info

ID:	289956
PubChem CID:	104391423
Reduced:	SN3O3C13H21 (1)
Stoich.:	AB3C3D13E21 (1)
Weight, g/mol:	260.209993
ΔH_f, kcal/mol:	-114.63
Dipole, Da:	5.57
IP(EA), eV:	-8.5(-0.25)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

2-[[2-ethyl-2-(hydroxymethyl)butyl]amino]-N-(2-methoxyethyl)propanamide

Drug info:

PubChemData

Smile

CC(C(=O)NCCOC)NCC1=C(C=CS1)NC(=O)C

DOS

IR

Vibrations