Geometry & MOs

Info

ID:	342049
PubChem CID:	127264762
Reduced:	SO2N3C15H19 (1)
Stoich.:	AB2C3D15E19 (1)
Weight, g/mol:	310.168128
ΔH_f, kcal/mol:	-48.91
Dipole, Da:	3.84
IP(EA), eV:	-8.93(-0.75)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

[3-[[3-(furan-2-yl)prop-2-enylamino]methyl]phenyl]-pyrrolidin-1-ylmethanone

Drug info:

PubChemData

Smile

CC1=NC(=CS1)NC(=O)NC(CCCO)C2=CC=CC=C2

DOS

IR

Vibrations