Geometry & MOs

Info

ID:	320301
PubChem CID:	126659394
Reduced:	PN2O4C13H17 (1)
Stoich.:	AB2C4D13E17 (1)
Weight, g/mol:	222.136828
ΔH_f, kcal/mol:	-197.76
Dipole, Da:	2.96
IP(EA), eV:	-8.49(-0.01)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

5-ethyl-3-(methylaminomethyl)-4-[(Z)-prop-1-enyl]furan-2-carboxamide

Drug info:

PubChemData

Smile

COC(=O)[C@H](CC1=CNC2=CC=CC=C21)NP(=O)(C)O

DOS

IR

Vibrations