Geometry & MOs

Info

ID:	230492
PubChem CID:	87571060
Reduced:	N2O2C41H78 (1)
Stoich.:	A2B2C41D78 (1)
Weight, g/mol:	389.05057
ΔH_f, kcal/mol:	-234.39
Dipole, Da:	5.44
IP(EA), eV:	-9.5(1.07)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

[1-[1-[[(5-bromo-6-chloropyridin-3-yl)amino]methyl]cyclopropyl]-2,2-dimethylpropyl]carbamic acid

Drug info:

PubChemData

Smile

CCCCCCCC/C=C/CCCCCCCC(=O)NCCCCCNC(=O)CCCCCCC/C=C/CCCCCCCC

DOS

IR

Vibrations