Geometry & MOs

Info

ID:	122788
PubChem CID:	50821445
Reduced:	N2O2C19H26 (1)
Stoich.:	A2B2C19D26 (1)
Weight, g/mol:	400.07864
ΔH_f, kcal/mol:	-58.01
Dipole, Da:	3.09
IP(EA), eV:	-8.82(-0.11)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

4-bromo-N-[4-[1-(propylcarbamoyl)cyclopropyl]phenyl]benzamide

Drug info:

PubChemData

Smile

CC(C)CCNC(=O)C1(CC1)C2=CC=C(C=C2)NC(=O)C3CC3

DOS

IR

Vibrations