Geometry & MOs

Info

ID:	192586
PubChem CID:	78287607
Reduced:	NO3C7H10 (2)
Stoich.:	AB3C7D10 (2)
Weight, g/mol:	388.163436
ΔH_f, kcal/mol:	-269.85
Dipole, Da:	3.78
IP(EA), eV:	-9.57(-0.6)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

[1-(2,3-dihydro-1,4-benzodioxin-6-ylamino)-1-oxopropan-2-yl] 4-(1-hydroxyethyl)-3,5-dimethyl-1H-pyrrole-2-carboxylate

Drug info:

PubChemData

Smile

CCOC(=O)NC(=O)COC(=O)C1=C(C(=C(N1)C)C(C)O)C

DOS

IR

Vibrations