Geometry & MOs

Info

ID:	419173
PubChem CID:	135107674
Reduced:	NO4C20H27 (1)
Stoich.:	AB4C20D27 (1)
Weight, g/mol:	344.178316
ΔH_f, kcal/mol:	-179.57
Dipole, Da:	3.95
IP(EA), eV:	-9.5(-0.05)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

N,N-dimethyl-1'-[(5-methyl-1,3,4-thiadiazol-2-yl)methyl]spiro[5,6-dihydrocyclopenta[d]pyrimidine-7,3'-piperidine]-2-amine

Drug info:

PubChemData

Smile

C1CCC(CC1)C(=O)N2CC[C@]([C@H](C2)O)(CC3=CC=CC=C3)C(=O)O

DOS

IR

Vibrations