Geometry & MOs

Info

ID:	417556
PubChem CID:	135102033
Reduced:	ON2C9H13 (2)
Stoich.:	AB2C9D13 (2)
Weight, g/mol:	326.221895
ΔH_f, kcal/mol:	-43.85
Dipole, Da:	2.88
IP(EA), eV:	-8.76(0.5)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

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

Drug info:

PubChemData

Smile

CC1=C(N=CN1)CN(CCO)C(=O)[C@H](CC2=CC=CC=C2)N(C)C

DOS

IR

Vibrations