Geometry & MOs

Info

ID:	140842
PubChem CID:	52768248
Reduced:	NO4C18H23 (1)
Stoich.:	AB4C18D23 (1)
Weight, g/mol:	423.110021
ΔH_f, kcal/mol:	-163.91
Dipole, Da:	4.13
IP(EA), eV:	-8.83(-0.58)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

methyl 5-[[5-methoxy-2-nitro-4-(1,3-thiazol-4-ylmethoxy)benzoyl]amino]pentanoate

Drug info:

PubChemData

Smile

CC1=C2C(=C(OC2=C(C=C1)C)C(=O)NCCCCC(=O)OC)C

DOS

IR

Vibrations