Geometry & MOs

Info

ID:	307727
PubChem CID:	125308707
Reduced:	O2N3C29H45 (1)
Stoich.:	A2B3C29D45 (1)
Weight, g/mol:	365.137556
ΔH_f, kcal/mol:	-125.33
Dipole, Da:	4.47
IP(EA), eV:	-8.31(0.39)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

5-(2,3-dihydro-1-benzofuran-5-yl)-N-(2,4-dimethoxyphenyl)-4H-pyrazole-3-carboxamide

Drug info:

PubChemData

Smile

CC(C)C1CCC(CC1)C(=O)N[C@H](CC2=CC=CC=C2)C(=O)NC[C@H]3CCCN4[C@H]3CCCC4

DOS

IR

Vibrations