Geometry & MOs

Info

ID:	153770
PubChem CID:	56313081
Reduced:	FO2N4H21C24 (1)
Stoich.:	AB2C4D21E24 (1)
Weight, g/mol:	435.176976
ΔH_f, kcal/mol:	-5.69
Dipole, Da:	2.95
IP(EA), eV:	-9.03(-1.1)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

N-[3-(1H-benzimidazol-2-yl)propyl]-3-[3-methoxy-4-(2,2,2-trifluoroethoxy)phenyl]propanamide

Drug info:

PubChemData

Smile

C1=CC=C2C(=C1)NC(=N2)CCCNC(=O)/C=C/C3=CC(=C(C=C3)OC4=CN=CC=C4)F

DOS

IR

Vibrations