Geometry & MOs

Info

ID:	270949
PubChem CID:	103638926
Reduced:	BrSN2C11H15 (1)
Stoich.:	ABC2D11E15 (1)
Weight, g/mol:	300.02958
ΔH_f, kcal/mol:	14.48
Dipole, Da:	5.17
IP(EA), eV:	-8.57(-0.72)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

1-(3-bromo-2-methylphenyl)-3-(2-methylpropyl)thiourea

Drug info:

PubChemData

Smile

CCCNC(=S)NC1=C(C(=CC=C1)Br)C

DOS

IR

Vibrations