Geometry & MOs

Info

ID:	175651
PubChem CID:	75931011
Reduced:	N3O4C26H29 (1)
Stoich.:	A3B4C26D29 (1)
Weight, g/mol:	352.099397
ΔH_f, kcal/mol:	-108.39
Dipole, Da:	7.84
IP(EA), eV:	-8.51(-0.16)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

N,N-bis(cyanomethyl)-3-[4-[(2-methyl-1,3-thiazol-4-yl)methoxy]phenyl]prop-2-enamide

Drug info:

PubChemData

Smile

C1CC(CN(C1)C(=O)C2CC2)C(=O)NC3CC(=O)N(C3)C4=CC=C(C=C4)OC5=CC=CC=C5

DOS

IR

Vibrations