Geometry & MOs

Info

ID:	423478
PubChem CID:	135119568
Reduced:	O2N4C19H30 (1)
Stoich.:	A2B4C19D30 (1)
Weight, g/mol:	380.221226
ΔH_f, kcal/mol:	-71.74
Dipole, Da:	4.11
IP(EA), eV:	-9.04(0.34)
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]-(2-methoxy-5-methylphenyl)methanone

Drug info:

PubChemData

Smile

CC[C@@]1(C[C@H]2CC[C@@H]1N2C3CCOCC3)C(=O)NCCC4=CN=CN4

DOS

IR

Vibrations