Geometry & MOs

Info

ID:	34843
PubChem CID:	7978998
Reduced:	O2S2N3C17H19 (1)
Stoich.:	A2B2C3D17E19 (1)
Weight, g/mol:	391.135448
ΔH_f, kcal/mol:	1.82
Dipole, Da:	7.4
IP(EA), eV:	-8.86(-1.1)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

3-benzyl-1-methyl-1-[(4-phenoxybenzoyl)amino]thiourea

Drug info:

PubChemData

Smile

CN(C(=S)NCC1=CC=CC=C1)NC(=O)CCC(=O)C2=CC=CS2

DOS

IR

Vibrations