Geometry & MOs

Info

ID:	419281
PubChem CID:	135107884
Reduced:	N4O4C15H18 (1)
Stoich.:	A4B4C15D18 (1)
Weight, g/mol:	415.16444
ΔH_f, kcal/mol:	-105.59
Dipole, Da:	5.63
IP(EA), eV:	-9.06(-0.56)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

2-[(2,5-diphenylpyrazole-3-carbonyl)-[(2-methyl-1H-imidazol-5-yl)methyl]amino]acetic acid

Drug info:

PubChemData

Smile

CC1=CC=C(O1)CCNC(=O)C2=NN3CC(CNC(=O)C3=C2)O

DOS

IR

Vibrations