Geometry & MOs

Info

ID:	158332
PubChem CID:	56463371
Reduced:	ON2C11H13 (2)
Stoich.:	AB2C11D13 (2)
Weight, g/mol:	404.221226
ΔH_f, kcal/mol:	28.16
Dipole, Da:	3.8
IP(EA), eV:	-8.76(-0.74)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

N-[2-[cyclopropyl(methyl)amino]propyl]-3-(2-methoxyphenyl)-1-phenylpyrazole-4-carboxamide

Drug info:

PubChemData

Smile

CC1=CC=C(O1)C2=NN(C=C2C(=O)NCC(C)N(C)C3CC3)C4=CC=CC=C4

DOS

IR

Vibrations