Geometry & MOs

Info

ID:	69693
PubChem CID:	47205191
Reduced:	NO3C15H15 (1)
Stoich.:	AB3C15D15 (1)
Weight, g/mol:	231.100777
ΔH_f, kcal/mol:	-50.68
Dipole, Da:	4.95
IP(EA), eV:	-9.25(-0.24)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

5-cyclopropyl-N-(furan-3-ylmethyl)-1H-pyrazole-3-carboxamide

Drug info:

PubChemData

Smile

C=CCOC1=CC=C(C=C1)C(=O)NCC2=COC=C2

DOS

IR

Vibrations