Geometry & MOs

Info

ID:	423870
PubChem CID:	135120545
Reduced:	N2O3C22H32 (1)
Stoich.:	A2B3C22D32 (1)
Weight, g/mol:	386.231791
ΔH_f, kcal/mol:	-108.83
Dipole, Da:	6.7
IP(EA), eV:	-8.32(0.17)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

N-[1-(dimethylamino)butan-2-yl]-5-(4-methoxyphenyl)-3-pyrrolidin-1-yl-1,2-oxazole-4-carboxamide

Drug info:

PubChemData

Smile

CCOC1=C(C=CC(=C1)CN(C)[C@@H]2C[C@@H]3CC(=O)NC[C@@H]3C2)OCC(=C)C

DOS

IR

Vibrations