Geometry & MOs

Info

ID:	63188
PubChem CID:	26746628
Reduced:	N2O4C11H20 (1)
Stoich.:	A2B4C11D20 (1)
Weight, g/mol:	322.116486
ΔH_f, kcal/mol:	-220.67
Dipole, Da:	0.93
IP(EA), eV:	-10.03(0.07)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

[(2S)-1-(2,3-dihydro-1,4-benzodioxin-6-ylcarbamoylamino)-1-oxopropan-2-yl] propanoate

Drug info:

PubChemData

Smile

CCC(=O)O[C@H](C)C(=O)NC(=O)NC(C)(C)C

DOS

IR

Vibrations