Geometry & MOs

Info

ID:	75792
PubChem CID:	48423985
Reduced:	NO2C10H12 (2)
Stoich.:	AB2C10D12 (2)
Weight, g/mol:	370.169271
ΔH_f, kcal/mol:	-95.93
Dipole, Da:	4.63
IP(EA), eV:	-8.64(-0.22)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

4-[2-(cyclopropylmethoxy)propanoylamino]-N-[(4-fluorophenyl)methyl]benzamide

Drug info:

PubChemData

Smile

CC(C(=O)NCC1=CC(=NC=C1)OC2=CC=C(C=C2)OC)OCC3CC3

DOS

IR

Vibrations