Geometry & MOs

Info

ID:	291714
PubChem CID:	113460400
Reduced:	SN2O2C13H18 (1)
Stoich.:	AB2C2D13E18 (1)
Weight, g/mol:	251.126991
ΔH_f, kcal/mol:	-68.13
Dipole, Da:	4.48
IP(EA), eV:	-8.51(-0.78)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

propan-2-yl N-(4-carbamimidoyl-2-methoxyphenyl)carbamate

Drug info:

PubChemData

Smile

CC(C)(C)C(=O)NC1=C(C=C(C=C1)C(=S)N)OC

DOS

IR

Vibrations