Geometry & MOs

Info

ID:	256308
PubChem CID:	103138352
Reduced:	ClNOC17H26 (1)
Stoich.:	ABCD17E26 (1)
Weight, g/mol:	223.05124
ΔH_f, kcal/mol:	-65.68
Dipole, Da:	1.76
IP(EA), eV:	-8.82(0.02)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

(3-chloropyridin-4-yl)-(1-methylpyrazol-3-yl)methanol

Drug info:

PubChemData

Smile

CCNCC(CC1CCC(O1)C)CC2=CC=CC=C2Cl

DOS

IR

Vibrations