Geometry & MOs

Info

ID:	137554
PubChem CID:	52227209
Reduced:	N2O4C23H28 (1)
Stoich.:	A2B4C23D28 (1)
Weight, g/mol:	386.075885
ΔH_f, kcal/mol:	-146.23
Dipole, Da:	5.05
IP(EA), eV:	-8.56(-0.47)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

(E)-N-[2-[bis(thiophen-2-ylmethyl)amino]-2-oxoethyl]-3-(furan-2-yl)prop-2-enamide

Drug info:

PubChemData

Smile

CC1=CC=C(C=C1)C(=O)N[C@H](C(C)C)C(=O)N[C@@H](C)C2=CC3=C(C=C2)OCCO3

DOS

IR

Vibrations