Geometry & MOs

Info

ID:	255210
PubChem CID:	103130668
Reduced:	NOC5H8 (2)
Stoich.:	ABC5D8 (2)
Weight, g/mol:	210.136828
ΔH_f, kcal/mol:	-62.8
Dipole, Da:	5.45
IP(EA), eV:	-9.16(0.58)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

(2-methyloxan-2-yl)-(1-methylpyrazol-3-yl)methanol

Drug info:

PubChemData

Smile

CC1(CCCO1)C(C2=NN(C=C2)C)O

DOS

IR

Vibrations