Geometry & MOs

Info

ID:	342982
PubChem CID:	127266145
Reduced:	N2O3C16H20 (1)
Stoich.:	A2B3C16D20 (1)
Weight, g/mol:	299.126991
ΔH_f, kcal/mol:	-88.66
Dipole, Da:	6.6
IP(EA), eV:	-9.27(-0.26)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

methyl 1-[[[2-(1H-pyrazol-4-yl)benzoyl]amino]methyl]cyclopropane-1-carboxylate

Drug info:

PubChemData

Smile

CN(CC(=O)NC1CCCOC2=CC=CC=C12)C(=O)C=C

DOS

IR

Vibrations