Geometry & MOs

Info

ID:	416439
PubChem CID:	135089452
Reduced:	N2O2C9H10 (2)
Stoich.:	A2B2C9D10 (2)
Weight, g/mol:	321.216475
ΔH_f, kcal/mol:	-43.53
Dipole, Da:	6.39
IP(EA), eV:	-10.05(-1.09)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

N-[2-(dimethylamino)ethyl]-N-[(5-methyl-1H-imidazol-4-yl)methyl]-3-propan-2-yl-4,5-dihydro-1,2-oxazole-5-carboxamide

Drug info:

PubChemData

Smile

CC1=CC(=C2C(=NOC2=N1)C)C(=O)N3C[C@H]([C@@H](C3)O)CC4=CC(=NO4)C

DOS

IR

Vibrations