Geometry & MOs

Info

ID:	281402
PubChem CID:	103913817
Reduced:	NO2C14H19 (1)
Stoich.:	AB2C14D19 (1)
Weight, g/mol:	275.163377
ΔH_f, kcal/mol:	-23.08
Dipole, Da:	5.11
IP(EA), eV:	-8.16(0.11)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

4-methoxy-2-[1-[2-(4-methylpyrazol-1-yl)ethylamino]ethyl]phenol

Drug info:

PubChemData

Smile

CC(C1=C(C=CC(=C1)OC)O)NCCCC#C

DOS

IR

Vibrations