Geometry & MOs

Info

ID:	363535
PubChem CID:	127311614
Reduced:	O2N3C13H25 (1)
Stoich.:	A2B3C13D25 (1)
Weight, g/mol:	386.155432
ΔH_f, kcal/mol:	-89.88
Dipole, Da:	5.08
IP(EA), eV:	-8.99(1.22)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

N-[(2,5-difluorophenyl)methyl]-4-(5-methyl-1,3-benzoxazol-2-yl)piperazine-1-carboxamide

Drug info:

PubChemData

Smile

CC1(CC1CNC(=O)NCC2CN(CCO2)C)C

DOS

IR

Vibrations