Geometry & MOs

Info

ID:	279894
PubChem CID:	103845560
Reduced:	NO3C14H23 (1)
Stoich.:	AB3C14D23 (1)
Weight, g/mol:	274.225643
ΔH_f, kcal/mol:	-142.29
Dipole, Da:	4.36
IP(EA), eV:	-8.79(0.18)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

tert-butyl N-[2-[[2-ethyl-2-(hydroxymethyl)butyl]amino]ethyl]carbamate

Drug info:

PubChemData

Smile

CCC(CC)(CNCC1=C(C=C(C=C1)O)O)CO

DOS

IR

Vibrations