Geometry & MOs

Info

ID:	368899
PubChem CID:	127330891
Reduced:	ON5C14H19 (1)
Stoich.:	AB5C14D19 (1)
Weight, g/mol:	398.231791
ΔH_f, kcal/mol:	14.1
Dipole, Da:	6.8
IP(EA), eV:	-8.74(-0.58)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

4-(cyclopropanecarbonylamino)-N-[2-(2,2-dimethylpropyl)-1,3-benzoxazol-5-yl]piperidine-1-carboxamide

Drug info:

PubChemData

Smile

CC1(CCCN(C1)C(=O)NC2=NN=C3N2C=CC=C3)C

DOS

IR

Vibrations