Geometry & MOs

Info

ID:	406177
PubChem CID:	135076777
Reduced:	BrNO2C22H22 (1)
Stoich.:	ABC2D22E22 (1)
Weight, g/mol:	195.089543
ΔH_f, kcal/mol:	-38.36
Dipole, Da:	3.0
IP(EA), eV:	-8.46(-1.14)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

ethyl N-(furan-2-yl)-N-prop-2-enylcarbamate

Drug info:

PubChemData

Smile

CCOC(=O)C1=CC(=C(C=C1)N2C(=CC=C2CC3=CC=C(C=C3)C)C)Br

DOS

IR

Vibrations