Geometry & MOs

Info

ID:	195907
PubChem CID:	78747458
Reduced:	SN2C17H24 (1)
Stoich.:	AB2C17D24 (1)
Weight, g/mol:	410.148656
ΔH_f, kcal/mol:	6.31
Dipole, Da:	5.41
IP(EA), eV:	-8.04(0.17)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

1-[(4-methoxyphenyl)methyl]-3-(2-methylphenyl)-1-(1-thiophen-2-ylpropan-2-yl)thiourea

Drug info:

PubChemData

Smile

CC1=CC=C(C=C1)NC(=S)N2CCCC3C2CCCC3

DOS

IR

Vibrations