Geometry & MOs

Info

ID:	281721
PubChem CID:	103914270
Reduced:	F2N2O2C13H18 (1)
Stoich.:	A2B2C2D13E18 (1)
Weight, g/mol:	350.04415
ΔH_f, kcal/mol:	-176.68
Dipole, Da:	4.18
IP(EA), eV:	-9.59(-0.68)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

2-[[5-bromo-2-(difluoromethoxy)phenyl]methylamino]-3-methylbutanamide

Drug info:

PubChemData

Smile

CC(C)C(C(=O)N)NCC(C1=C(C=CC=C1F)F)O

DOS

IR

Vibrations