Geometry & MOs

Info

ID:	323133
PubChem CID:	126672821
Reduced:	N5C31H31 (1)
Stoich.:	A5B31C31 (1)
Weight, g/mol:	374.141262
ΔH_f, kcal/mol:	128.6
Dipole, Da:	3.23
IP(EA), eV:	-7.79(-0.25)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

5-(3,4-dimethoxyphenyl)-N-(oxan-4-ylmethyl)imidazo[2,1-b][1,3,4]thiadiazol-2-amine

Drug info:

PubChemData

Smile

CN1CCN(CC1)C2=CC=C(C=C2)NC3=NC=C4C=C(N(C4=C3)CC5=CC=CC=C5)C6=CC=CC=C6

DOS

IR

Vibrations