Geometry & MOs

Info

ID:	258723
PubChem CID:	103156618
Reduced:	N2O4C15H22 (1)
Stoich.:	A2B4C15D22 (1)
Weight, g/mol:	204.147393
ΔH_f, kcal/mol:	-156.33
Dipole, Da:	8.7
IP(EA), eV:	-9.16(-0.92)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

4-amino-N-(1-hydroxypropan-2-yl)-3-methoxy-N-methylbutanamide

Drug info:

PubChemData

Smile

CN(CCC1=CC=CC=C1C(=O)O)C(=O)CC(CN)OC

DOS

IR

Vibrations