Geometry & MOs

Info

ID:	421232
PubChem CID:	135115626
Reduced:	ClN4O4C19H25 (1)
Stoich.:	AB4C4D19E25 (1)
Weight, g/mol:	337.19026
ΔH_f, kcal/mol:	-106.46
Dipole, Da:	7.94
IP(EA), eV:	-9.15(-1.03)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

[2-(dimethylamino)spiro[5,6-dihydrocyclopenta[d]pyrimidine-7,3'-piperidine]-1'-yl]-pyridin-4-ylmethanone

Drug info:

PubChemData

Smile

CC(C)(C(=O)N(C)C)NC(=O)C1=C(ON=C1NCCOC)C2=CC=C(C=C2)Cl

DOS

IR

Vibrations