Geometry & MOs

Info

ID:	273551
PubChem CID:	103771354
Reduced:	BrNSO2C14H22 (1)
Stoich.:	ABCD2E14F22 (1)
Weight, g/mol:	211.120843
ΔH_f, kcal/mol:	-96.3
Dipole, Da:	2.27
IP(EA), eV:	-9.3(-0.36)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

N-(2-hydroxy-4-methylpentyl)furan-3-carboxamide

Drug info:

PubChemData

Smile

CC(C)CC(CNC(=O)CCCC1=CC=C(S1)Br)O

DOS

IR

Vibrations