Geometry & MOs

Info

ID:	70799
PubChem CID:	48413887
Reduced:	O3N5C18H21 (1)
Stoich.:	A3B5C18D21 (1)
Weight, g/mol:	285.184112
ΔH_f, kcal/mol:	-80.93
Dipole, Da:	6.69
IP(EA), eV:	-9.19(-0.61)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

2-[4-(2-methylpropyl)phenyl]-N-[(5-methyl-1H-pyrazol-4-yl)methyl]acetamide

Drug info:

PubChemData

Smile

CC1=C(C=NN1)CNC(=O)CNC(=O)C2=CC=C(C=C2)N3CCCC3=O

DOS

IR

Vibrations