Geometry & MOs

Info

ID:	414703
PubChem CID:	135087662
Reduced:	NOC8H9 (3)
Stoich.:	ABC8D9 (3)
Weight, g/mol:	291.169525
ΔH_f, kcal/mol:	-73.61
Dipole, Da:	2.51
IP(EA), eV:	-8.7(-0.3)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

N-(2-hydroxyethyl)-N-[(2-methyl-1H-imidazol-5-yl)methyl]-2-pyrazol-1-ylbutanamide

Drug info:

PubChemData

Smile

CC1=CC=CN2C1=NC=C2CC(=O)N3CCC4(CC3)C5=C(CCO4)C=C(C=C5)OC

DOS

IR

Vibrations