Geometry & MOs

Info

ID:	271345
PubChem CID:	103655025
Reduced:	NO4C16H31 (1)
Stoich.:	AB4C16D31 (1)
Weight, g/mol:	287.163377
ΔH_f, kcal/mol:	-216.01
Dipole, Da:	3.62
IP(EA), eV:	-9.61(1.68)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

[4-[(1-phenylpyrazol-4-yl)methylamino]oxan-4-yl]methanol

Drug info:

PubChemData

Smile

CC1CCC(CC1)OCC(CNC2(CCOCC2)CO)O

DOS

IR

Vibrations