Geometry & MOs

Info

ID:	367800
PubChem CID:	127325897
Reduced:	NOC5H7 (4)
Stoich.:	ABC5D7 (4)
Weight, g/mol:	358.211724
ΔH_f, kcal/mol:	-100.79
Dipole, Da:	7.73
IP(EA), eV:	-9.59(-0.21)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

1-methyl-N-[4-[[methyl-(1-methylpyrazole-4-carbonyl)amino]methyl]cyclohexyl]pyrazole-4-carboxamide

Drug info:

PubChemData

Smile

CC1=C(C(=NO1)C)C(=O)NC2CCC(CC2)CN(C)C(=O)C3=C(ON=C3C)C

DOS

IR

Vibrations