Geometry & MOs

Info

ID:	280881
PubChem CID:	103851735
Reduced:	O2N3C18H25 (1)
Stoich.:	A2B3C18D25 (1)
Weight, g/mol:	239.163377
ΔH_f, kcal/mol:	-69.24
Dipole, Da:	5.3
IP(EA), eV:	-9.21(-0.83)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

[4-[(1,3-dimethylpyrazol-4-yl)methylamino]oxan-4-yl]methanol

Drug info:

PubChemData

Smile

CC(C)(C)OC(=O)N1CCCC(C1)NCC2=CC=CC=C2C#N

DOS

IR

Vibrations