Geometry & MOs

Info

ID:	422532
PubChem CID:	135117996
Reduced:	O2N3C16H23 (1)
Stoich.:	A2B3C16D23 (1)
Weight, g/mol:	371.130363
ΔH_f, kcal/mol:	-19.22
Dipole, Da:	3.8
IP(EA), eV:	-9.15(0.05)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

2-cyclopropyl-5-(spiro[6,7-dihydrothieno[3,2-c]pyran-4,4'-piperidine]-1'-carbonyl)-1H-pyrimidin-6-one

Drug info:

PubChemData

Smile

CN(CC1=NOC(=C1)C2CC2)[C@@H]3C[C@@H]4CC(=O)NC[C@@H]4C3

DOS

IR

Vibrations