Geometry & MOs

Info

ID:	172561
PubChem CID:	75524889
Reduced:	N2O3C19H26 (1)
Stoich.:	A2B3C19D26 (1)
Weight, g/mol:	370.146347
ΔH_f, kcal/mol:	-130.4
Dipole, Da:	4.81
IP(EA), eV:	-10.01(-0.75)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

(Z)-2-cyano-N-(5,6-dihydro-4H-cyclopenta[d][1,3]thiazol-2-yl)-3-[1-(2-methoxyethyl)-2,5-dimethylpyrrol-3-yl]prop-2-enamide

Drug info:

PubChemData

Smile

CC1(C2CCC1(C(C2)OC(=O)C3=CC=C(C=C3)CNC(=O)N)C)C

DOS

IR

Vibrations