Geometry & MOs

Info

ID:	70911
PubChem CID:	48414036
Reduced:	O2N3C17H23 (1)
Stoich.:	A2B3C17D23 (1)
Weight, g/mol:	373.142641
ΔH_f, kcal/mol:	-45.11
Dipole, Da:	2.9
IP(EA), eV:	-8.86(0.23)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

3-methyl-N-[(5-methyl-1H-pyrazol-4-yl)methyl]-4-oxo-2-phenylchromene-8-carboxamide

Drug info:

PubChemData

Smile

CC1=C(C=CC(=C1)OCC(=O)NCC2=C(NN=C2)C)C(C)C

DOS

IR

Vibrations