Geometry & MOs

Info

ID:	291443
PubChem CID:	112379011
Reduced:	O2N5C18H19 (1)
Stoich.:	A2B5C18D19 (1)
Weight, g/mol:	329.210327
ΔH_f, kcal/mol:	29.65
Dipole, Da:	7.75
IP(EA), eV:	-9.17(-1.38)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

2-ethyl-N-(3-hydroxy-4-phenylbutan-2-yl)-5-propan-2-ylpyrazole-3-carboxamide

Drug info:

PubChemData

Smile

CC(C(CC1=CC=CC=C1)O)NC(=O)C2=CC=CC=C2N3C=NN=N3

DOS

IR

Vibrations