Geometry & MOs

Info

ID:	258905
PubChem CID:	103157393
Reduced:	SN2O3C14H30 (1)
Stoich.:	AB2C3D14E30 (1)
Weight, g/mol:	246.157957
ΔH_f, kcal/mol:	-169.7
Dipole, Da:	6.15
IP(EA), eV:	-9.11(0.46)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

4-[[2-(butan-2-ylamino)acetyl]amino]-3-methoxybutanoic acid

Drug info:

PubChemData

Smile

CCN(CCCNCC(CC1CCCC1)O)S(=O)(=O)C

DOS

IR

Vibrations