Geometry & MOs

Info

ID:	329121
PubChem CID:	126731322
Reduced:	C7N9H12 (2)
Stoich.:	A7B9C12 (2)
Weight, g/mol:	289.124883
ΔH_f, kcal/mol:	132.55
Dipole, Da:	1.26
IP(EA), eV:	-9.21(0.01)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

N-tert-butyl-N,4-dimethyl-2-pyridin-3-yl-1,3-thiazole-5-carboxamide

Drug info:

PubChemData

Smile

CNC1=NC(=NC(=N1)N)NCCNC2=NC(=NC(=N2)NCCNC3=NC(=NC(=N3)N)N)N

DOS

IR

Vibrations