Geometry & MOs

Info

ID:	416940
PubChem CID:	135090837
Reduced:	O2N5C16H21 (1)
Stoich.:	A2B5C16D21 (1)
Weight, g/mol:	366.205576
ΔH_f, kcal/mol:	-17.74
Dipole, Da:	6.66
IP(EA), eV:	-9.41(-0.17)
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]-(4-hydroxy-2-methylphenyl)methanone

Drug info:

PubChemData

Smile

CC1=NN(C(=C1)N)CC(=O)N[C@H]2COC[C@H]2CC3=CC=NC=C3

DOS

IR

Vibrations