Geometry & MOs

Info

ID:	330139
PubChem CID:	127247126
Reduced:	ON4C18H22 (1)
Stoich.:	AB4C18D22 (1)
Weight, g/mol:	311.163377
ΔH_f, kcal/mol:	14.57
Dipole, Da:	6.2
IP(EA), eV:	-8.44(-0.19)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

[1-(4-methoxyphenyl)cyclopropyl]-[3-(1H-pyrazol-5-yl)pyrrolidin-1-yl]methanone

Drug info:

PubChemData

Smile

C1CCN(C1)C2=CC=C(C=C2)C(=O)N3CCC(C3)C4=CC=NN4

DOS

IR

Vibrations