Geometry & MOs

Info

ID:	342699
PubChem CID:	127265859
Reduced:	NSO2H17C21 (1)
Stoich.:	ABC2D17E21 (1)
Weight, g/mol:	324.147393
ΔH_f, kcal/mol:	11.28
Dipole, Da:	2.32
IP(EA), eV:	-9.11(-0.73)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

N-cyclopropyl-4-[[furan-2-ylmethyl(prop-2-enoyl)amino]methyl]benzamide

Drug info:

PubChemData

Smile

CC1=C(SC=C1)C(=O)NC(C2=CC=CC=C2)C3=CC4=CC=CC=C4O3

DOS

IR

Vibrations