Geometry & MOs

Info

ID:	74195
PubChem CID:	48421572
Reduced:	O3N5C18H23 (1)
Stoich.:	A3B5C18D23 (1)
Weight, g/mol:	375.136511
ΔH_f, kcal/mol:	-44.09
Dipole, Da:	3.74
IP(EA), eV:	-8.64(-0.68)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

ethyl 3-[cyclopropylmethyl-[(5-pyridin-2-yl-1,3,4-thiadiazol-2-yl)carbamoyl]amino]propanoate

Drug info:

PubChemData

Smile

CCOC(=O)CCN(CC1CC1)C(=O)NC2=C(N=CC=C2)N3C=CC=N3

DOS

IR

Vibrations