Geometry & MOs

Info

ID:	361321
PubChem CID:	127302516
Reduced:	N2O2C10H13 (2)
Stoich.:	A2B2C10D13 (2)
Weight, g/mol:	383.232125
ΔH_f, kcal/mol:	-123.04
Dipole, Da:	2.86
IP(EA), eV:	-8.22(0.14)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

4-[(4,5-dimethyl-1,3-oxazol-2-yl)methyl]-N-(3-pyrrolidin-1-ylphenyl)piperazine-1-carboxamide

Drug info:

PubChemData

Smile

CC1=C(OC(=N1)CN2CCN(CC2)C(=O)NC3=CC4=C(C=C3)OC(O4)(C)C)C

DOS

IR

Vibrations