Geometry & MOs

Info

ID:	268802
PubChem CID:	103601026
Reduced:	SN2C14H30 (1)
Stoich.:	AB2C14D30 (1)
Weight, g/mol:	288.223535
ΔH_f, kcal/mol:	-52.03
Dipole, Da:	5.61
IP(EA), eV:	-8.2(0.24)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

3-(1-methoxypropan-2-yl)-1,1-bis(3-methylbutyl)thiourea

Drug info:

PubChemData

Smile

CC(C)CCN(CCC(C)C)C(=S)NC(C)C

DOS

IR

Vibrations