Geometry & MOs

Info

ID:	36424
PubChem CID:	8006366
Reduced:	ClSO2N3H16C19 (1)
Stoich.:	ABC2D3E16F19 (1)
Weight, g/mol:	394.097873
ΔH_f, kcal/mol:	14.49
Dipole, Da:	7.12
IP(EA), eV:	-8.91(-1.22)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

2-[1-(3-chlorophenyl)tetrazol-5-yl]sulfanyl-N-(cyclohexylcarbamoyl)acetamide

Drug info:

PubChemData

Smile

CN(CC1=CC=CO1)CC2=NC(=O)C3=C(N2)C=C(S3)C4=CC=C(C=C4)Cl

DOS

IR

Vibrations