Geometry & MOs

Info

ID:	172365
PubChem CID:	75498547
Reduced:	NO2C16H23 (1)
Stoich.:	AB2C16D23 (1)
Weight, g/mol:	288.158626
ΔH_f, kcal/mol:	-105.38
Dipole, Da:	4.2
IP(EA), eV:	-9.19(0.14)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

N-[(2S)-1-hydroxy-3-methylbutan-2-yl]-2-(4-phenyltriazol-1-yl)acetamide

Drug info:

PubChemData

Smile

CC1=CC(=C(C=C1)C(=O)N2CCCCC2C(C)O)C

DOS

IR

Vibrations