Geometry & MOs

Info

ID:	126700
PubChem CID:	50973502
Reduced:	N2O2C19H30 (1)
Stoich.:	A2B2C19D30 (1)
Weight, g/mol:	344.184841
ΔH_f, kcal/mol:	-74.16
Dipole, Da:	2.52
IP(EA), eV:	-8.53(0.26)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

N-[2-methoxy-5-[3-(1H-pyrazol-4-yl)propanoylamino]phenyl]pentanamide

Drug info:

PubChemData

Smile

C1CCC(C1)N2CCCN(CC2)CC3=CC=C(C=C3)OCCO

DOS

IR

Vibrations