Geometry & MOs

Info

ID:	414860
PubChem CID:	135087832
Reduced:	N2O2C21H32 (1)
Stoich.:	A2B2C21D32 (1)
Weight, g/mol:	354.205576
ΔH_f, kcal/mol:	-94.37
Dipole, Da:	3.16
IP(EA), eV:	-9.09(0.28)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

2,4-dimethyl-6-[[4-(pyridin-2-ylmethoxy)piperidin-1-yl]methyl]-5,6-dihydrofuro[2,3-d]pyrimidine

Drug info:

PubChemData

Smile

CC(C)(CC(=O)N1CC[C@]2(CCCN([C@@H]2C1)C)CO)C3=CC=CC=C3

DOS

IR

Vibrations