Geometry & MOs

Info

ID:	418138
PubChem CID:	135103649
Reduced:	N5O7C33H45 (1)
Stoich.:	A5B7C33D45 (1)
Weight, g/mol:	349.143784
ΔH_f, kcal/mol:	-273.08
Dipole, Da:	10.89
IP(EA), eV:	-8.24(-0.04)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

3-(dimethylamino)-5-(4-fluoro-3-methoxyphenyl)-N-(oxolan-3-yl)-1,2-oxazole-4-carboxamide

Drug info:

PubChemData

Smile

CC[C@H]1CN(CC(=O)N[C@@H](C(=O)N[C@H](C(=O)N[C@H](C(=O)N1)CC2=CC=CC=C2)CC(C)C)C)C(=O)COC3=CC=CC=C3OC

DOS

IR

Vibrations