Geometry & MOs

Info

ID:	69286
PubChem CID:	46530584
Reduced:	O3N5C20H21 (1)
Stoich.:	A3B5C20D21 (1)
Weight, g/mol:	376.04226
ΔH_f, kcal/mol:	-55.87
Dipole, Da:	5.59
IP(EA), eV:	-8.18(-0.45)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

4-[[[(E)-3-(5-bromofuran-2-yl)prop-2-enoyl]amino]methyl]-N,N-dimethylbenzamide

Drug info:

PubChemData

Smile

C=CCNC(=O)NC1=CC=C(C=C1)NC(=O)C2=CC=C(C=C2)N3CCNC3=O

DOS

IR

Vibrations