Geometry & MOs

Info

ID:	177940
PubChem CID:	76254672
Reduced:	N4O5C19H20 (1)
Stoich.:	A4B5C19D20 (1)
Weight, g/mol:	382.244087
ΔH_f, kcal/mol:	-87.78
Dipole, Da:	6.86
IP(EA), eV:	-9.47(-1.46)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

6-amino-1-butyl-5-[2-methoxyethyl-[(1-propyltetrazol-5-yl)methyl]amino]-1,3-diazinane-2,4-dione

Drug info:

PubChemData

Smile

CC1=NOC(=C1)NC(=O)C(C)OC(=O)CCCC2=NC(=O)C3C=CC=CC3=N2

DOS

IR

Vibrations