Geometry & MOs

Info

ID:	263105
PubChem CID:	103339641
Reduced:	O2N3C13H25 (1)
Stoich.:	A2B3C13D25 (1)
Weight, g/mol:	258.157957
ΔH_f, kcal/mol:	-68.17
Dipole, Da:	2.97
IP(EA), eV:	-8.85(1.05)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

3-[[2-methoxyethyl(prop-2-enyl)carbamoyl]amino]-2-methylbutanoic acid

Drug info:

PubChemData

Smile

CC(C(=O)N(CCOC)CC=C)N1CCNCC1

DOS

IR

Vibrations