Geometry & MOs

Info

ID:	58644
PubChem CID:	24712389
Reduced:	N2O5C16H16 (1)
Stoich.:	A2B5C16D16 (1)
Weight, g/mol:	300.147393
ΔH_f, kcal/mol:	-107.52
Dipole, Da:	4.92
IP(EA), eV:	-8.91(-0.9)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

2-[[cyclopropyl-[(2,5-dimethylphenyl)methyl]amino]methyl]-1,3-oxazole-4-carboxylic acid

Drug info:

PubChemData

Smile

C1CC1N(CC2=CC3=C(C=C2)OCO3)CC4=NC(=CO4)C(=O)O

DOS

IR

Vibrations